Hugging Face's logo

Datasets:
jarod0411
/
cm_v6_idx4

Modalities:
Tabular
Text
Formats:
parquet
Size:
1M - 10M
Libraries:
Datasets
pandas
Dataset card Viewer Files Community
Dataset Viewer
Auto-converted to Parquet
Full Screen
prompt
stringlengths
47
229
first_mask_count
int64
0
16
first_start_index
int64
0
176
first_mask_gen_count
int64
1
16
first_mask_tokens
stringlengths
0
16
first_mask_gen_count_real
int64
0
19
generated_smiles
stringlengths
10
199
original_smiles
stringlengths
10
192
generated_tokens
stringlengths
0
19
<|startoftext|><L>CC(C<mask_1:5>(O)c1ccccc1[S@@](=O)c1ccc(Cl)cc1<mask_1:5>
1
4
5
)
5
CC(C)(C)C(O)c1ccccc1[S@@](=O)c1ccc(Cl)cc1
CC(C)(O)c1ccccc1[S@@](=O)c1ccc(Cl)cc1
)(C)C
<|startoftext|><L>CC(C)(O)c1ccccc1[S@@](=O)c1ccc(<mask_1:1>)cc1<mask_1:1>
2
31
1
Cl
1
CC(C)(O)c1ccccc1[S@@](=O)c1ccc(F)cc1
CC(C)(O)c1ccccc1[S@@](=O)c1ccc(Cl)cc1
F
<|startoftext|><L>CC(C)(O)c1ccccc1[S@@](=O<mask_1:4>ccc(Cl)cc1<mask_1:4>
3
24
4
)c1
4
CC(C)(O)c1ccccc1[S@@](=O)Cc1ccc(Cl)cc1
CC(C)(O)c1ccccc1[S@@](=O)c1ccc(Cl)cc1
)Cc1
<|startoftext|><L>C<mask_1:4>(C)(O)c1ccccc1[S@@](=O)c1ccc(Cl)cc1<mask_1:4>
1
1
4
C
4
C[C@](C)(O)c1ccccc1[S@@](=O)c1ccc(Cl)cc1
CC(C)(O)c1ccccc1[S@@](=O)c1ccc(Cl)cc1
[C@]
<|startoftext|><L><mask_1:4>C)(O)c1ccccc1[S@@](=O)c1ccc(Cl)cc1<mask_1:4>
3
0
4
CC(
4
COC(C)(O)c1ccccc1[S@@](=O)c1ccc(Cl)cc1
CC(C)(O)c1ccccc1[S@@](=O)c1ccc(Cl)cc1
COC(
<|startoftext|><L>CC(C)(O)c1ccccc1[<mask_1:4>=O)c1ccc(Cl)cc1<mask_1:4>
5
17
4
S@@](
4
CC(C)(O)c1ccccc1[S@](=O)c1ccc(Cl)cc1
CC(C)(O)c1ccccc1[S@@](=O)c1ccc(Cl)cc1
S@](
<|startoftext|><L>C<mask_1:1>C)(O)c1ccccc1[S@@](=O)c1ccc(Cl)cc1<mask_1:1>
2
1
1
C(
1
C(C)(O)c1ccccc1[S@@](=O)c1ccc(Cl)cc1
CC(C)(O)c1ccccc1[S@@](=O)c1ccc(Cl)cc1
(
<|startoftext|><L>CC(C)(O)c1ccccc1[S@@](=O)c1<mask_1:2>(Cl)cc1<mask_1:2>
3
27
2
ccc
2
CC(C)(O)c1ccccc1[S@@](=O)c1sc(Cl)cc1
CC(C)(O)c1ccccc1[S@@](=O)c1ccc(Cl)cc1
sc
<|startoftext|><L>CC(C)(O)c1cccc<mask_1:4>S@@](=O)c1ccc(Cl)cc1<mask_1:4>
3
14
4
c1[
4
CC(C)(O)c1ccccc1C[S@@](=O)c1ccc(Cl)cc1
CC(C)(O)c1ccccc1[S@@](=O)c1ccc(Cl)cc1
c1C[
<|startoftext|><L>CC(C)(O)c1ccccc1[S@@](=O)c1ccc(Cl)c<mask_1:4>c1<mask_1:4>
0
35
4
4
CC(C)(O)c1ccccc1[S@@](=O)c1ccc(Cl)c(Cl)c1
CC(C)(O)c1ccccc1[S@@](=O)c1ccc(Cl)cc1
(Cl)
<|startoftext|><L>Cc1ccc(N2CC[C@@H](N3CCN(c4ccccc4F)CC3)[C<mask_1:2>H](O)C2)nn1<mask_1:2>
1
40
2
@
2
Cc1ccc(N2CC[C@@H](N3CCN(c4ccccc4F)CC3)[C@@H](O)C2)nn1
Cc1ccc(N2CC[C@@H](N3CCN(c4ccccc4F)CC3)[C@H](O)C2)nn1
@@
<|startoftext|><L>Cc1ccc(N2CC[C@@H](N3CCN(c4ccccc<mask_1:5>CC3)[C@H](O)C2)nn1<mask_1:5>
3
31
5
4F)
5
Cc1ccc(N2CC[C@@H](N3CCN(c4ccccc4C#N)CC3)[C@H](O)C2)nn1
Cc1ccc(N2CC[C@@H](N3CCN(c4ccccc4F)CC3)[C@H](O)C2)nn1
4C#N)
<|startoftext|><L>Cc<mask_1:5>2CC[C@@H](N3CCN(c4ccccc4F)CC3)[C@H](O)C2)nn1<mask_1:5>
6
2
5
1ccc(N
5
Cc1cn(C2CC[C@@H](N3CCN(c4ccccc4F)CC3)[C@H](O)C2)nn1
Cc1ccc(N2CC[C@@H](N3CCN(c4ccccc4F)CC3)[C@H](O)C2)nn1
1cn(C
<|startoftext|><L>Cc1ccc(N2CC[C@@H](N3CCN(c4ccccc4F)CC3)[<mask_1:6>(O)C2)nn1<mask_1:6>
4
39
6
C@H]
6
Cc1ccc(N2CC[C@@H](N3CCN(c4ccccc4F)CC3)[C@](C)(O)C2)nn1
Cc1ccc(N2CC[C@@H](N3CCN(c4ccccc4F)CC3)[C@H](O)C2)nn1
C@](C)
<|startoftext|><L>Cc1ccc(N2CC[<mask_1:1>H](N3CCN(c4ccccc4F)CC3)[C@H](O)C2)nn1<mask_1:1>
3
12
1
C@@
1
Cc1ccc(N2CC[CH](N3CCN(c4ccccc4F)CC3)[C@H](O)C2)nn1
Cc1ccc(N2CC[C@@H](N3CCN(c4ccccc4F)CC3)[C@H](O)C2)nn1
C
<|startoftext|><L>Cc1ccc(N2CC[C@@H](N3CCN(c4ccccc4<mask_1:4>C3)[C@H](O)C2)nn1<mask_1:4>
3
32
4
F)C
4
Cc1ccc(N2CC[C@@H](N3CCN(c4ccccc4Cl)CC3)[C@H](O)C2)nn1
Cc1ccc(N2CC[C@@H](N3CCN(c4ccccc4F)CC3)[C@H](O)C2)nn1
Cl)C
<|startoftext|><L>Cc1ccc(N2CC[C@@H](N3CCN(c4ccccc4F)CC<mask_1:7>H](O)C2)nn1<mask_1:7>
5
36
7
3)[C@
6
Cc1ccc(N2CC[C@@H](N3CCN(c4ccccc4F)CC3)[C@@H](O)C2)nn1
Cc1ccc(N2CC[C@@H](N3CCN(c4ccccc4F)CC3)[C@H](O)C2)nn1
3)[C@@
<|startoftext|><L>Cc1ccc(N2CC[C@@H]<mask_1:4>N(c4ccccc4F)CC3)[C@H](O)C2)nn1<mask_1:4>
5
17
4
(N3CC
4
Cc1ccc(N2CC[C@@H](C3CN(c4ccccc4F)CC3)[C@H](O)C2)nn1
Cc1ccc(N2CC[C@@H](N3CCN(c4ccccc4F)CC3)[C@H](O)C2)nn1
(C3C
<|startoftext|><L>Cc1ccc(N2CC[C@@H](N3CCN(c4ccccc4F)CC3)[C@H](O)C2)<mask_1:5>1<mask_1:5>
2
49
5
nn
5
Cc1ccc(N2CC[C@@H](N3CCN(c4ccccc4F)CC3)[C@H](O)C2)c(C)n1
Cc1ccc(N2CC[C@@H](N3CCN(c4ccccc4F)CC3)[C@H](O)C2)nn1
c(C)n
<|startoftext|><L>Cc1ccc(N2CC[C@@H](N3CCN(c4ccccc4F)CC<mask_1:3>(O)C2)nn1<mask_1:3>
7
36
3
3)[C@H]
3
Cc1ccc(N2CC[C@@H](N3CCN(c4ccccc4F)CC3)C(O)C2)nn1
Cc1ccc(N2CC[C@@H](N3CCN(c4ccccc4F)CC3)[C@H](O)C2)nn1
3)C
<|startoftext|><L>O=C(N=c1[nH][nH]c2c1CO<mask_1:4>)c1cccc(-c2ccccc2)n1<mask_1:4>
3
22
4
CC2
4
O=C(N=c1[nH][nH]c2c1COCC2O)c1cccc(-c2ccccc2)n1
O=C(N=c1[nH][nH]c2c1COCC2)c1cccc(-c2ccccc2)n1
CC2O
<|startoftext|><L>O=C(N=c1[nH][nH]c2c1COCC2)c1cccc(-c2ccc<mask_1:5>n1<mask_1:5>
4
39
5
cc2)
5
O=C(N=c1[nH][nH]c2c1COCC2)c1cccc(-c2cccnc2O)n1
O=C(N=c1[nH][nH]c2c1COCC2)c1cccc(-c2ccccc2)n1
nc2O)
<|startoftext|><L>O=C(N=c1[nH][nH]c2c1COCC2)c1cccc(-c2cc<mask_1:4>c2)n1<mask_1:4>
2
38
4
cc
4
O=C(N=c1[nH][nH]c2c1COCC2)c1cccc(-c2ccn(C)c2)n1
O=C(N=c1[nH][nH]c2c1COCC2)c1cccc(-c2ccccc2)n1
n(C)
<|startoftext|><L>O=C(N=c1[nH][nH]c2c1COCC2)c1cccc(-c2c<mask_1:5>ccc2)n1<mask_1:5>
1
37
5
c
5
O=C(N=c1[nH][nH]c2c1COCC2)c1cccc(-c2cc(Cl)ccc2)n1
O=C(N=c1[nH][nH]c2c1COCC2)c1cccc(-c2ccccc2)n1
c(Cl)
<|startoftext|><L>O=C(<mask_1:6>N=c1[nH][nH]c2c1COCC2)c1cccc(-c2ccccc2)n1<mask_1:6>
0
4
6
6
O=C(NC(=O)N=c1[nH][nH]c2c1COCC2)c1cccc(-c2ccccc2)n1
O=C(N=c1[nH][nH]c2c1COCC2)c1cccc(-c2ccccc2)n1
NC(=O)
<|startoftext|><L>O=C(N=c1[nH][nH<mask_1:3>]c2c1COCC2)c1cccc(-c2ccccc2)n1<mask_1:3>
0
15
3
4
O=C(N=c1[nH][nH][nH]c2c1COCC2)c1cccc(-c2ccccc2)n1
O=C(N=c1[nH][nH]c2c1COCC2)c1cccc(-c2ccccc2)n1
][nH
<|startoftext|><L>O=C(N=c1[nH][nH]c2c1COCC2)c1cccc(-c2ccc<mask_1:1>2)n1<mask_1:1>
2
39
1
cc
1
O=C(N=c1[nH][nH]c2c1COCC2)c1cccc(-c2cccs2)n1
O=C(N=c1[nH][nH]c2c1COCC2)c1cccc(-c2ccccc2)n1
s
<|startoftext|><L>O=C(N=c1[nH][nH]c2<mask_1:3>C2)c1cccc(-c2ccccc2)n1<mask_1:3>
5
18
3
c1COC
3
O=C(N=c1[nH][nH]c2c1CC2)c1cccc(-c2ccccc2)n1
O=C(N=c1[nH][nH]c2c1COCC2)c1cccc(-c2ccccc2)n1
c1C
<|startoftext|><L>O=C(N=c1[nH][nH]c2c1COCC<mask_1:3>2)c1cccc(-c2ccccc2)n1<mask_1:3>
0
24
3
3
O=C(N=c1[nH][nH]c2c1COCCNCC2)c1cccc(-c2ccccc2)n1
O=C(N=c1[nH][nH]c2c1COCC2)c1cccc(-c2ccccc2)n1
NCC
<|startoftext|><L>O=C(N=c1[<mask_1:4>nH][nH]c2c1COCC2)c1cccc(-c2ccccc2)n1<mask_1:4>
0
9
4
4
O=C(N=c1[nH][nH][nH]c2c1COCC2)c1cccc(-c2ccccc2)n1
O=C(N=c1[nH][nH]c2c1COCC2)c1cccc(-c2ccccc2)n1
nH][
<|startoftext|><L>COc1ccc(/C=C2\Oc3cc(OC(C)=O)ccc3C<mask_1:2>1<mask_1:2>
6
33
2
2=O)cc
2
COc1ccc(/C=C2\Oc3cc(OC(C)=O)ccc3C2)1
COc1ccc(/C=C2\Oc3cc(OC(C)=O)ccc3C2=O)cc1
2)
<|startoftext|><L>COc1ccc(/C=C2\Oc3cc(OC(C)=O)ccc3C<mask_1:2>)cc1<mask_1:2>
3
33
2
2=O
3
COc1ccc(/C=C2\Oc3cc(OC(C)=O)ccc3C2=O)cc1
COc1ccc(/C=C2\Oc3cc(OC(C)=O)ccc3C2=O)cc1
2=O
<|startoftext|><L>COc1ccc(/C=C2\Oc3cc(OC(C)<mask_1:1>c3C2=O)cc1<mask_1:1>
5
25
1
=O)cc
1
COc1ccc(/C=C2\Oc3cc(OC(C))c3C2=O)cc1
COc1ccc(/C=C2\Oc3cc(OC(C)=O)ccc3C2=O)cc1
)
<|startoftext|><L>CO<mask_1:5>1ccc(/C=C2\Oc3cc(OC(C)=O)ccc3C2=O)cc1<mask_1:5>
1
2
5
c
5
COCCCOc1ccc(/C=C2\Oc3cc(OC(C)=O)ccc3C2=O)cc1
COc1ccc(/C=C2\Oc3cc(OC(C)=O)ccc3C2=O)cc1
CCCOc
<|startoftext|><L>COc1ccc(/C=C2\Oc3cc(OC(C)=O)ccc3<mask_1:6>2=O)cc1<mask_1:6>
1
32
6
C
6
COc1ccc(/C=C2\Oc3cc(OC(C)=O)ccc3C(=O)C2=O)cc1
COc1ccc(/C=C2\Oc3cc(OC(C)=O)ccc3C2=O)cc1
C(=O)C
<|startoftext|><L>COc1ccc(/C=C<mask_1:4>2\Oc3cc(OC(C)=O)ccc3C2=O)cc1<mask_1:4>
0
12
4
4
COc1ccc(/C=C/[C]2\Oc3cc(OC(C)=O)ccc3C2=O)cc1
COc1ccc(/C=C2\Oc3cc(OC(C)=O)ccc3C2=O)cc1
/[C]
<|startoftext|><L>COc1ccc(/C=C2<mask_1:1>c3cc(OC(C)=O)ccc3C2=O)cc1<mask_1:1>
2
13
1
\O
1
COc1ccc(/C=C2Cc3cc(OC(C)=O)ccc3C2=O)cc1
COc1ccc(/C=C2\Oc3cc(OC(C)=O)ccc3C2=O)cc1
C
<|startoftext|><L>COc1ccc(/C=C2\Oc3cc(OC(C<mask_1:6>)=O)ccc3C2=O)cc1<mask_1:6>
0
24
6
6
COc1ccc(/C=C2\Oc3cc(OC(C)=CC(N)=O)ccc3C2=O)cc1
COc1ccc(/C=C2\Oc3cc(OC(C)=O)ccc3C2=O)cc1
)=CC(N
<|startoftext|><L>COc1ccc(/C=C<mask_1:2>2\Oc3cc(OC(C)=O)ccc3C2=O)cc1<mask_1:2>
0
12
2
2
COc1ccc(/C=C/C2\Oc3cc(OC(C)=O)ccc3C2=O)cc1
COc1ccc(/C=C2\Oc3cc(OC(C)=O)ccc3C2=O)cc1
/C
<|startoftext|><L>COc1ccc(<mask_1:3>Oc3cc(OC(C)=O)ccc3C2=O)cc1<mask_1:3>
6
8
3
/C=C2\
3
COc1ccc(N2COc3cc(OC(C)=O)ccc3C2=O)cc1
COc1ccc(/C=C2\Oc3cc(OC(C)=O)ccc3C2=O)cc1
N2C
<|startoftext|><L>CCn1nccc1C(=O<mask_1:4>H](C)[C@@H]1C[C@H]2CC[C@H]1C2<mask_1:4>
5
13
4
)N[C@
4
CCn1nccc1C(=O)N[CH](C)[C@@H]1C[C@H]2CC[C@H]1C2
CCn1nccc1C(=O)N[C@H](C)[C@@H]1C[C@H]2CC[C@H]1C2
)N[C
<|startoftext|><L>CCn1nc<mask_1:6>(=O)N[C@H](C)[C@@H]1C[C@H]2CC[C@H]1C2<mask_1:6>
4
6
6
cc1C
6
CCn1nccc1CNC(=O)N[C@H](C)[C@@H]1C[C@H]2CC[C@H]1C2
CCn1nccc1C(=O)N[C@H](C)[C@@H]1C[C@H]2CC[C@H]1C2
cc1CNC
<|startoftext|><L>CCn1nccc1C(=O)N[C@H](C<mask_1:5>]1C[C@H]2CC[C@H]1C2<mask_1:5>
6
22
5
)[C@@H
5
CCn1nccc1C(=O)N[C@H](C)[C@H]1C[C@H]2CC[C@H]1C2
CCn1nccc1C(=O)N[C@H](C)[C@@H]1C[C@H]2CC[C@H]1C2
)[C@H
<|startoftext|><L>CCn1nccc1C(=O)N<mask_1:5>)[C@@H]1C[C@H]2CC[C@H]1C2<mask_1:5>
7
15
5
[C@H](C
5
CCn1nccc1C(=O)NCCN(C)[C@@H]1C[C@H]2CC[C@H]1C2
CCn1nccc1C(=O)N[C@H](C)[C@@H]1C[C@H]2CC[C@H]1C2
CCN(C
<|startoftext|><L>CCn1nccc1C<mask_1:2>=O)N[C@H](C)[C@@H]1C[C@H]2CC[C@H]1C2<mask_1:2>
1
10
2
(
2
CCn1nccc1CC(=O)N[C@H](C)[C@@H]1C[C@H]2CC[C@H]1C2
CCn1nccc1C(=O)N[C@H](C)[C@@H]1C[C@H]2CC[C@H]1C2
C(
<|startoftext|><L>CCn1nccc1C(=O<mask_1:5>[C@H](C)[C@@H]1C[C@H]2CC[C@H]1C2<mask_1:5>
2
13
5
)N
5
CCn1nccc1C(=O)N(C)[C@H](C)[C@@H]1C[C@H]2CC[C@H]1C2
CCn1nccc1C(=O)N[C@H](C)[C@@H]1C[C@H]2CC[C@H]1C2
)N(C)
<|startoftext|><L>CCn1nccc1C(=O)N[C@H](<mask_1:7>@@H]1C[C@H]2CC[C@H]1C2<mask_1:7>
4
21
7
C)[C
7
CCn1nccc1C(=O)N[C@H](COC)C[C@@H]1C[C@H]2CC[C@H]1C2
CCn1nccc1C(=O)N[C@H](C)[C@@H]1C[C@H]2CC[C@H]1C2
COC)C[C
<|startoftext|><L>CCn1nccc1C(=O)N[C@H](C)[C@@H]1C[C@H]2C<mask_1:7>@H]1C2<mask_1:7>
3
38
7
C[C
7
CCn1nccc1C(=O)N[C@H](C)[C@@H]1C[C@H]2CC(=O)[C@H]1C2
CCn1nccc1C(=O)N[C@H](C)[C@@H]1C[C@H]2CC[C@H]1C2
C(=O)[C
<|startoftext|><L>CCn1nccc1C(=O)N[C@H](C)[C@@H]1C[C@H]2<mask_1:2>1C2<mask_1:2>
7
37
2
CC[C@H]
2
CCn1nccc1C(=O)N[C@H](C)[C@@H]1C[C@H]2CC1C2
CCn1nccc1C(=O)N[C@H](C)[C@@H]1C[C@H]2CC[C@H]1C2
CC
<|startoftext|><L>CC<mask_1:3>1nccc1C(=O)N[C@H](C)[C@@H]1C[C@H]2CC[C@H]1C2<mask_1:3>
1
2
3
n
3
CCCCn1nccc1C(=O)N[C@H](C)[C@@H]1C[C@H]2CC[C@H]1C2
CCn1nccc1C(=O)N[C@H](C)[C@@H]1C[C@H]2CC[C@H]1C2
CCn
<|startoftext|><L>C[C@@H](C(=O)O)N1CCN(c2c<mask_1:1>Br)cn2)CC1<mask_1:1>
3
24
1
cc(
1
C[C@@H](C(=O)O)N1CCN(c2c(Br)cn2)CC1
C[C@@H](C(=O)O)N1CCN(c2ccc(Br)cn2)CC1
(
<|startoftext|><L>C[C@@H](C(=O)O)N1CCN(<mask_1:2>2ccc(Br)cn2)CC1<mask_1:2>
1
21
2
c
2
C[C@@H](C(=O)O)N1CCN(Cc2ccc(Br)cn2)CC1
C[C@@H](C(=O)O)N1CCN(c2ccc(Br)cn2)CC1
Cc
<|startoftext|><L>C[C@@H](C(=O)O)N1CCN(c2ccc(Br)cn2)C<mask_1:5>C1<mask_1:5>
0
35
5
5
C[C@@H](C(=O)O)N1CCN(c2ccc(Br)cn2)C(=O)CC1
C[C@@H](C(=O)O)N1CCN(c2ccc(Br)cn2)CC1
(=O)C
<|startoftext|><L>C[C@@H](C(=O)O)N1C<mask_1:3>(c2ccc(Br)cn2)CC1<mask_1:3>
2
18
3
CN
3
C[C@@H](C(=O)O)N1CCCN(c2ccc(Br)cn2)CC1
C[C@@H](C(=O)O)N1CCN(c2ccc(Br)cn2)CC1
CCN
<|startoftext|><L>C[C@@H]<mask_1:5>O)O)N1CCN(c2ccc(Br)cn2)CC1<mask_1:5>
4
7
5
(C(=
5
C[C@@H](CC(=O)O)N1CCN(c2ccc(Br)cn2)CC1
C[C@@H](C(=O)O)N1CCN(c2ccc(Br)cn2)CC1
(CC(=
<|startoftext|><L>C[<mask_1:1>H](C(=O)O)N1CCN(c2ccc(Br)cn2)CC1<mask_1:1>
3
2
1
C@@
1
C[CH](C(=O)O)N1CCN(c2ccc(Br)cn2)CC1
C[C@@H](C(=O)O)N1CCN(c2ccc(Br)cn2)CC1
C
<|startoftext|><L>C[C@@H]<mask_1:4>(C(=O)O)N1CCN(c2ccc(Br)cn2)CC1<mask_1:4>
0
7
4
4
C[C@@H](N)C(C(=O)O)N1CCN(c2ccc(Br)cn2)CC1
C[C@@H](C(=O)O)N1CCN(c2ccc(Br)cn2)CC1
(N)C
<|startoftext|><L>C[C@@H](C(=O)O)<mask_1:2>N1CCN(c2ccc(Br)cn2)CC1<mask_1:2>
0
15
2
2
C[C@@H](C(=O)O)CCN1CCN(c2ccc(Br)cn2)CC1
C[C@@H](C(=O)O)N1CCN(c2ccc(Br)cn2)CC1
CC
<|startoftext|><L>C[C@@H](C(=O)O)<mask_1:2>CN(c2ccc(Br)cn2)CC1<mask_1:2>
3
15
2
N1C
2
C[C@@H](C(=O)O)N1CN(c2ccc(Br)cn2)CC1
C[C@@H](C(=O)O)N1CCN(c2ccc(Br)cn2)CC1
N1
<|startoftext|><L>C[C@@H](C(=O)O)N1CCN(c2c<mask_1:4>c(Br)cn2)CC1<mask_1:4>
1
24
4
c
4
C[C@@H](C(=O)O)N1CCN(c2cc(F)c(Br)cn2)CC1
C[C@@H](C(=O)O)N1CCN(c2ccc(Br)cn2)CC1
c(F)
<|startoftext|><L>O=C(COCc1cccc(Cl<mask_1:5>N[C@@H]1CCC[C@@H]1N1CC[C@@H](O)C1<mask_1:5>
4
16
5
)c1)
5
O=C(COCc1cccc(Cl)c1F)N[C@@H]1CCC[C@@H]1N1CC[C@@H](O)C1
O=C(COCc1cccc(Cl)c1)N[C@@H]1CCC[C@@H]1N1CC[C@@H](O)C1
)c1F)
<|startoftext|><L>O=C(COCc1cccc(Cl)c1)<mask_1:6>@@H]1CCC[C@@H]1N1CC[C@@H](O)C1<mask_1:6>
3
20
6
N[C
6
O=C(COCc1cccc(Cl)c1)N(C)[C@@H]1CCC[C@@H]1N1CC[C@@H](O)C1
O=C(COCc1cccc(Cl)c1)N[C@@H]1CCC[C@@H]1N1CC[C@@H](O)C1
N(C)[C
<|startoftext|><L>O=C(COCc1cccc(Cl)c1)N[C@@H]1CCC[C@@H]1<mask_1:6>[C@@H](O)C1<mask_1:6>
4
38
6
N1CC
6
O=C(COCc1cccc(Cl)c1)N[C@@H]1CCC[C@@H]1N1CCOC[C@@H](O)C1
O=C(COCc1cccc(Cl)c1)N[C@@H]1CCC[C@@H]1N1CC[C@@H](O)C1
N1CCOC
<|startoftext|><L>O=C(COCc1cccc(Cl)c1)N[C@@<mask_1:4>C[C@@H]1N1CC[C@@H](O)C1<mask_1:4>
5
25
4
H]1CC
4
O=C(COCc1cccc(Cl)c1)N[C@@H]1CC[C@@H]1N1CC[C@@H](O)C1
O=C(COCc1cccc(Cl)c1)N[C@@H]1CCC[C@@H]1N1CC[C@@H](O)C1
H]1C
<|startoftext|><L>O=C(<mask_1:4>cccc(Cl)c1)N[C@@H]1CCC[C@@H]1N1CC[C@@H](O)C1<mask_1:4>
5
4
4
COCc1
4
O=C(COc1cccc(Cl)c1)N[C@@H]1CCC[C@@H]1N1CC[C@@H](O)C1
O=C(COCc1cccc(Cl)c1)N[C@@H]1CCC[C@@H]1N1CC[C@@H](O)C1
COc1
<|startoftext|><L>O=C(COCc1cccc(Cl)c1)N[C@@H]1CCC[C@@H]1<mask_1:3>1CC[C@@H](O)C1<mask_1:3>
1
38
3
N
3
O=C(COCc1cccc(Cl)c1)N[C@@H]1CCC[C@@H]1NCC1CC[C@@H](O)C1
O=C(COCc1cccc(Cl)c1)N[C@@H]1CCC[C@@H]1N1CC[C@@H](O)C1
NCC
<|startoftext|><L>O=C(COCc1cccc(Cl)c1)N[C@@H]1CCC[C@@H]1N<mask_1:7>[C@@H](O)C1<mask_1:7>
3
39
7
1CC
7
O=C(COCc1cccc(Cl)c1)N[C@@H]1CCC[C@@H]1N1CCC(O)[C@@H](O)C1
O=C(COCc1cccc(Cl)c1)N[C@@H]1CCC[C@@H]1N1CC[C@@H](O)C1
1CCC(O)
<|startoftext|><L>O=C(COCc1cccc(Cl)c1)N[<mask_1:6>CC[C@@H]1N1CC[C@@H](O)C1<mask_1:6>
7
22
6
C@@H]1C
6
O=C(COCc1cccc(Cl)c1)N[C@H]1CCC[C@@H]1N1CC[C@@H](O)C1
O=C(COCc1cccc(Cl)c1)N[C@@H]1CCC[C@@H]1N1CC[C@@H](O)C1
C@H]1C
<|startoftext|><L>O=C(COCc1cccc(Cl)c1)N[C@@H]1<mask_1:7>CC[C@@H]1N1CC[C@@H](O)C1<mask_1:7>
1
28
7
C
8
O=C(COCc1cccc(Cl)c1)N[C@@H]1c2ccccc2CC[C@@H]1N1CC[C@@H](O)C1
O=C(COCc1cccc(Cl)c1)N[C@@H]1CCC[C@@H]1N1CC[C@@H](O)C1
c2ccccc2
<|startoftext|><L>O=C(COCc1cccc(Cl)c1)N[C@@H]1CCC[C@@H<mask_1:6>1N1CC[C@@H](O)C1<mask_1:6>
1
36
6
]
6
O=C(COCc1cccc(Cl)c1)N[C@@H]1CCC[C@@H](CO)C1N1CC[C@@H](O)C1
O=C(COCc1cccc(Cl)c1)N[C@@H]1CCC[C@@H]1N1CC[C@@H](O)C1
](CO)C
<|startoftext|><L>CCCn1c(=O)n(C)c(=O)c2c(S<mask_1:4>)Nc3cc(C)on3)nc(C(C)(C)C)nc21<mask_1:4>
5
24
4
CC(=O
4
CCCn1c(=O)n(C)c(=O)c2c(SC(=O)Nc3cc(C)on3)nc(C(C)(C)C)nc21
CCCn1c(=O)n(C)c(=O)c2c(SCC(=O)Nc3cc(C)on3)nc(C(C)(C)C)nc21
C(=O
<|startoftext|><L>CCCn1c(=O)n(C)c(=O)c2c(SCC(=O)Nc3cc(C)on3)nc(C<mask_1:2>C)C)nc21<mask_1:2>
4
46
2
(C)(
2
CCCn1c(=O)n(C)c(=O)c2c(SCC(=O)Nc3cc(C)on3)nc(CC(C)C)nc21
CCCn1c(=O)n(C)c(=O)c2c(SCC(=O)Nc3cc(C)on3)nc(C(C)(C)C)nc21
C(
<|startoftext|><L>CCCn1c(=O)n<mask_1:3>c2c(SCC(=O)Nc3cc(C)on3)nc(C(C)(C)C)nc21<mask_1:3>
8
11
3
(C)c(=O)
3
CCCn1c(=O)n(C)c2c(SCC(=O)Nc3cc(C)on3)nc(C(C)(C)C)nc21
CCCn1c(=O)n(C)c(=O)c2c(SCC(=O)Nc3cc(C)on3)nc(C(C)(C)C)nc21
(C)
<|startoftext|><L>CCCn1c(=O)n(C)c(=O)c2c(SCC(=O)Nc3cc(C)on3)nc(<mask_1:2>C)C)nc21<mask_1:2>
5
45
2
C(C)(
2
CCCn1c(=O)n(C)c(=O)c2c(SCC(=O)Nc3cc(C)on3)nc(C(C)C)nc21
CCCn1c(=O)n(C)c(=O)c2c(SCC(=O)Nc3cc(C)on3)nc(C(C)(C)C)nc21
C(
<|startoftext|><L>CCCn1c(=O)n<mask_1:4>=O)c2c(SCC(=O)Nc3cc(C)on3)nc(C(C)(C)C)nc21<mask_1:4>
5
11
4
(C)c(
4
CCCn1c(=O)n(CCC=O)c2c(SCC(=O)Nc3cc(C)on3)nc(C(C)(C)C)nc21
CCCn1c(=O)n(C)c(=O)c2c(SCC(=O)Nc3cc(C)on3)nc(C(C)(C)C)nc21
(CCC
<|startoftext|><L>CCCn1c(=O)n(C)c(=O)c2c(SCC(=O)N<mask_1:4>3cc(C)on3)nc(C(C)(C)C)nc21<mask_1:4>
1
31
4
c
4
CCCn1c(=O)n(C)c(=O)c2c(SCC(=O)N(C)c3cc(C)on3)nc(C(C)(C)C)nc21
CCCn1c(=O)n(C)c(=O)c2c(SCC(=O)Nc3cc(C)on3)nc(C(C)(C)C)nc21
(C)c
<|startoftext|><L>CCCn1c(=O)n(C)c(=O)c<mask_1:4>SCC(=O)Nc3cc(C)on3)nc(C(C)(C)C)nc21<mask_1:4>
3
20
4
2c(
4
CCCn1c(=O)n(C)c(=O)c2c(CSCC(=O)Nc3cc(C)on3)nc(C(C)(C)C)nc21
CCCn1c(=O)n(C)c(=O)c2c(SCC(=O)Nc3cc(C)on3)nc(C(C)(C)C)nc21
2c(C
<|startoftext|><L>CCCn1c(=O)n(C)c(=O)c2c(SCC(=O)Nc3cc<mask_1:5>n3)nc(C(C)(C)C)nc21<mask_1:5>
4
35
5
(C)o
5
CCCn1c(=O)n(C)c(=O)c2c(SCC(=O)Nc3cccc(C)n3)nc(C(C)(C)C)nc21
CCCn1c(=O)n(C)c(=O)c2c(SCC(=O)Nc3cc(C)on3)nc(C(C)(C)C)nc21
cc(C)
<|startoftext|><L>CCCn1c(=O)n(C)c(=O)c2c(SCC(=O)Nc3cc(C)on3)nc<mask_1:3>(C)C)nc21<mask_1:3>
5
44
3
(C(C)
3
CCCn1c(=O)n(C)c(=O)c2c(SCC(=O)Nc3cc(C)on3)nc(CC(C)C)nc21
CCCn1c(=O)n(C)c(=O)c2c(SCC(=O)Nc3cc(C)on3)nc(C(C)(C)C)nc21
(CC
<|startoftext|><L>CCCn1c(=O)n(C)c(=O)c2c(SCC(=O)Nc<mask_1:7>on3)nc(C(C)(C)C)nc21<mask_1:7>
6
32
7
3cc(C)
7
CCCn1c(=O)n(C)c(=O)c2c(SCC(=O)Nc3cc(CC)on3)nc(C(C)(C)C)nc21
CCCn1c(=O)n(C)c(=O)c2c(SCC(=O)Nc3cc(C)on3)nc(C(C)(C)C)nc21
3cc(CC)
<|startoftext|><L>Cc1cc(CN[C@@H](C)Cn2ccc<mask_1:3>n2)on1<mask_1:3>
0
23
3
3
Cc1cc(CN[C@@H](C)Cn2ccc(C)n2)on1
Cc1cc(CN[C@@H](C)Cn2cccn2)on1
(C)
<|startoftext|><L>Cc1cc(CN[C@@H]<mask_1:1>n2cccn2)on1<mask_1:1>
4
14
1
(C)C
1
Cc1cc(CN[C@@H]Cn2cccn2)on1
Cc1cc(CN[C@@H](C)Cn2cccn2)on1
C
<|startoftext|><L>Cc1cc<mask_1:4>[C@@H](C)Cn2cccn2)on1<mask_1:4>
3
5
4
(CN
4
Cc1cc(CNC[C@@H](C)Cn2cccn2)on1
Cc1cc(CN[C@@H](C)Cn2cccn2)on1
(CNC
<|startoftext|><L>Cc1c<mask_1:4>CN[C@@H](C)Cn2cccn2)on1<mask_1:4>
2
4
4
c(
4
Cc1cc(CCCN[C@@H](C)Cn2cccn2)on1
Cc1cc(CN[C@@H](C)Cn2cccn2)on1
c(CC
<|startoftext|><L>Cc1<mask_1:4>CN[C@@H](C)Cn2cccn2)on1<mask_1:4>
3
3
4
cc(
4
Cc1cc(CCN[C@@H](C)Cn2cccn2)on1
Cc1cc(CN[C@@H](C)Cn2cccn2)on1
cc(C
<|startoftext|><L>Cc1cc(C<mask_1:3>C@@H](C)Cn2cccn2)on1<mask_1:3>
2
7
3
N[
3
Cc1cc(CNC[C@@H](C)Cn2cccn2)on1
Cc1cc(CN[C@@H](C)Cn2cccn2)on1
NC[
<|startoftext|><L>Cc1cc(<mask_1:1>C@@H](C)Cn2cccn2)on1<mask_1:1>
3
6
1
CN[
1
Cc1cc([C@@H](C)Cn2cccn2)on1
Cc1cc(CN[C@@H](C)Cn2cccn2)on1
[
<|startoftext|><L>Cc1cc(CN<mask_1:2>H](C)Cn2cccn2)on1<mask_1:2>
4
8
2
[C@@
2
Cc1cc(CN[CH](C)Cn2cccn2)on1
Cc1cc(CN[C@@H](C)Cn2cccn2)on1
[C
<|startoftext|><L>Cc1cc(CN<mask_1:2>C@@H](C)Cn2cccn2)on1<mask_1:2>
1
8
2
[
2
Cc1cc(CNC[C@@H](C)Cn2cccn2)on1
Cc1cc(CN[C@@H](C)Cn2cccn2)on1
C[
<|startoftext|><L>Cc1cc(CN[C@@H](C)Cn2cccn2)<mask_1:3>1<mask_1:3>
2
26
3
on
3
Cc1cc(CN[C@@H](C)Cn2cccn2)ccn1
Cc1cc(CN[C@@H](C)Cn2cccn2)on1
ccn
<|startoftext|><L>COc1ccc(-c2no<mask_1:4>N)c2C(N)=O)cc1<mask_1:4>
2
13
4
c(
4
COc1ccc(-c2noc(CCN)c2C(N)=O)cc1
COc1ccc(-c2noc(N)c2C(N)=O)cc1
c(CC
<|startoftext|><L>COc1ccc(-c2noc(N<mask_1:1>2C(N)=O)cc1<mask_1:1>
2
16
1
)c
1
COc1ccc(-c2noc(N)2C(N)=O)cc1
COc1ccc(-c2noc(N)c2C(N)=O)cc1
)
<|startoftext|><L>COc1ccc(-c2no<mask_1:3>N)c2C(N)=O)cc1<mask_1:3>
2
13
3
c(
3
COc1ccc(-c2noc(CN)c2C(N)=O)cc1
COc1ccc(-c2noc(N)c2C(N)=O)cc1
c(C
<|startoftext|><L>COc1ccc(-c2noc(N)c2C(N)=<mask_1:3>1<mask_1:3>
4
24
3
O)cc
3
COc1ccc(-c2noc(N)c2C(N)=O)s1
COc1ccc(-c2noc(N)c2C(N)=O)cc1
O)s
<|startoftext|><L><mask_1:3>ccc(-c2noc(N)c2C(N)=O)cc1<mask_1:3>
4
0
3
COc1
3
Cc1ccc(-c2noc(N)c2C(N)=O)cc1
COc1ccc(-c2noc(N)c2C(N)=O)cc1
Cc1
<|startoftext|><L>COc1ccc(-c<mask_1:4>c(N)c2C(N)=O)cc1<mask_1:4>
3
10
4
2no
4
COc1ccc(-c2cccc(N)c2C(N)=O)cc1
COc1ccc(-c2noc(N)c2C(N)=O)cc1
2ccc
<|startoftext|><L>COc1ccc(-c2noc(N)c2C<mask_1:1>O)cc1<mask_1:1>
4
20
1
(N)=
1
COc1ccc(-c2noc(N)c2CCO)cc1
COc1ccc(-c2noc(N)c2C(N)=O)cc1
C
<|startoftext|><L>COc1cc<mask_1:4>c2noc(N)c2C(N)=O)cc1<mask_1:4>
3
6
4
c(-
4
COc1ccc(OCc2noc(N)c2C(N)=O)cc1
COc1ccc(-c2noc(N)c2C(N)=O)cc1
c(OC
<|startoftext|><L>COc1ccc(-c2noc(N)c2C(N<mask_1:3>cc1<mask_1:3>
4
22
3
)=O)
3
COc1ccc(-c2noc(N)c2C(N)O)cc1
COc1ccc(-c2noc(N)c2C(N)=O)cc1
)O)
<|startoftext|><L>COc1ccc(-c2noc(N)c2<mask_1:4>(N)=O)cc1<mask_1:4>
1
19
4
C
4
COc1ccc(-c2noc(N)c2SCCC(N)=O)cc1
COc1ccc(-c2noc(N)c2C(N)=O)cc1
SCCC
End of preview. Expand in Dataset Viewer.
README.md exists but content is empty. Use the Edit dataset card button to edit it.
Downloads last month
34
Edit dataset card
Size of downloaded dataset files:
52.9 MB
Size of the auto-converted Parquet files:
52.9 MB
Number of rows:
1,000,000