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COS(=O)(=O)[O-].C[N+]1(C)CCN(CC(O)(c2ccccc2)C2CCCCC2)CC1
Is this molecule characterized by a small molecular structure or a protein sequence?
It has a small molecule structure.
COS(=O)(=O)[O-].C[N+]1(C)CCN(CC(O)(c2ccccc2)C2CCCCC2)CC1
Please provide a description of this drug's mechanism of action.
Muscarinic acetylcholine receptor M1 antagonist
COS(=O)(=O)[O-].C[N+]1(C)CCN(CC(O)(c2ccccc2)C2CCCCC2)CC1
Determine if this molecule is inorganic, meaning it contains only metal atoms and fewer than two carbon atoms.
No
COS(=O)(=O)[O-].C[N+]1(C)CCN(CC(O)(c2ccccc2)C2CCCCC2)CC1
What is the highest development stage achieved for this compound across all indications? Please respond with Approved, Phase 3 Clinical Trials, Phase 2 Clinical Trials, Phase 1 Clinical Trials, Early Phase 1 Clinical Trials, or Clinical Phase Unknown.
Approved
COS(=O)(=O)[O-].C[N+]1(C)CCN(CC(O)(c2ccccc2)C2CCCCC2)CC1
Is there a black box warning associated with this drug?
No
COS(=O)(=O)[O-].C[N+]1(C)CCN(CC(O)(c2ccccc2)C2CCCCC2)CC1
Is it known if this drug is the first approved in its class, regardless of the indication or route of administration, acting on a specific target?
No
COS(=O)(=O)[O-].C[N+]1(C)CCN(CC(O)(c2ccccc2)C2CCCCC2)CC1
Is this drug used for therapeutic purposes, rather than for imaging, additives, or other non-therapeutic applications?
Yes
COS(=O)(=O)[O-].C[N+]1(C)CCN(CC(O)(c2ccccc2)C2CCCCC2)CC1
What is the definition of this compound's USAN stem?
quaternary ammonium derivatives
COS(=O)(=O)[O-].C[N+]1(C)CCN(CC(O)(c2ccccc2)C2CCCCC2)CC1
Has this approved drug been withdrawn due to toxicity reasons for all indications, populations, and doses in at least one country (not necessarily the US)?
No
COS(=O)(=O)[O-].C[N+]1(C)CCN(CC(O)(c2ccccc2)C2CCCCC2)CC1
How many violations of Lipinski's Rule of Five (using HBA and HBD definitions) are there for this compound?
0
COS(=O)(=O)[O-].C[N+]1(C)CCN(CC(O)(c2ccccc2)C2CCCCC2)CC1
How many aromatic rings does this compound have?
1
COS(=O)(=O)[O-].C[N+]1(C)CCN(CC(O)(c2ccccc2)C2CCCCC2)CC1
Is this compound an acid, a base, or neutral?
NEUTRAL
COS(=O)(=O)[O-].C[N+]1(C)CCN(CC(O)(c2ccccc2)C2CCCCC2)CC1
What is the molecular weight of this compound's parent molecule?
317.5
COS(=O)(=O)[O-].C[N+]1(C)CCN(CC(O)(c2ccccc2)C2CCCCC2)CC1
How many heavy (non-hydrogen) atoms does this compound have?
23
COS(=O)(=O)[O-].C[N+]1(C)CCN(CC(O)(c2ccccc2)C2CCCCC2)CC1
What is the first recorded year of approval for this drug?
1982
COS(=O)(=O)[O-].C[N+]1(C)CCN(CC(O)(c2ccccc2)C2CCCCC2)CC1
Is it known whether this drug is taken orally?
Yes
COS(=O)(=O)[O-].C[N+]1(C)CCN(CC(O)(c2ccccc2)C2CCCCC2)CC1
How many hydrogen bond acceptors does this compound have?
2
COS(=O)(=O)[O-].C[N+]1(C)CCN(CC(O)(c2ccccc2)C2CCCCC2)CC1
Is the drug administered in this specific form, such as a particular salt?
Yes
COS(=O)(=O)[O-].C[N+]1(C)CCN(CC(O)(c2ccccc2)C2CCCCC2)CC1
Determine if this compound is a prodrug.
No
COS(=O)(=O)[O-].C[N+]1(C)CCN(CC(O)(c2ccccc2)C2CCCCC2)CC1
Please provide a description of this drug's mechanism of action.
Muscarinic acetylcholine receptor M3 antagonist
COS(=O)(=O)[O-].C[N+]1(C)CCN(CC(O)(c2ccccc2)C2CCCCC2)CC1
How many hydrogen bond donors does this compound have?
1
COS(=O)(=O)[O-].C[N+]1(C)CCN(CC(O)(c2ccccc2)C2CCCCC2)CC1
Which USAN substem can this drug or clinical candidate name be matched with?
-ium
COS(=O)(=O)[O-].C[N+]1(C)CCN(CC(O)(c2ccccc2)C2CCCCC2)CC1
What is the classification of this molecule? Please respond with Small Molecule, Protein, Antibody, Oligosaccharide, Oligonucleotide, Cell, Enzyme, Gene, or Unknown.
Small molecule
COS(=O)(=O)[O-].C[N+]1(C)CCN(CC(O)(c2ccccc2)C2CCCCC2)CC1
What is the calculated ALogP value for this compound?
2.85
COS(=O)(=O)[O-].C[N+]1(C)CCN(CC(O)(c2ccccc2)C2CCCCC2)CC1
What is the molecular formula of this compound, including any salt that it may have?
C21H36N2O5S
COS(=O)(=O)[O-].C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1
Determine the type of availability for this drug.
discontinued
COS(=O)(=O)[O-].C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1
Determine if this drug is administered as a racemic mixture, a single stereoisomer, an achiral molecule, or has an unknown chirality.
An achiral molecule
COS(=O)(=O)[O-].C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1
Does this compound satisfy the rule-of-three criteria?
No
COS(=O)(=O)[O-].C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1
How many violations of Lipinski's Rule of Five are there for this compound, using the HBA_LIPINSKI and HBD_LIPINSKI counts?
0
COS(=O)(=O)[O-].C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1
Is it known whether this drug is administered parenterally?
No
COS(=O)(=O)[O-].C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1
Is it known whether this drug is applied topically?
No
COS(=O)(=O)[O-].C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1
What is the molecular formula of this compound, including any salt that it may have?
C21H27NO4S
COS(=O)(=O)[O-].C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1
What is the polar surface area (PSA) value of this compound?
0
COS(=O)(=O)[O-].C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1
Is this compound a small molecule polymer, such as polystyrene sulfonate?
No
COS(=O)(=O)[O-].C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1
What is the molecular weight of this compound's parent molecule?
278.42
COS(=O)(=O)[O-].C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1
Is this molecule characterized by a small molecular structure or a protein sequence?
It has a small molecule structure.
COS(=O)(=O)[O-].C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1
Please provide a description of this drug's mechanism of action.
Muscarinic acetylcholine receptor M1 antagonist
COS(=O)(=O)[O-].C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1
Determine if this molecule is inorganic, meaning it contains only metal atoms and fewer than two carbon atoms.
No
COS(=O)(=O)[O-].C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1
What is the highest development stage achieved for this compound across all indications? Please respond with Approved, Phase 3 Clinical Trials, Phase 2 Clinical Trials, Phase 1 Clinical Trials, Early Phase 1 Clinical Trials, or Clinical Phase Unknown.
Approved
COS(=O)(=O)[O-].C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1
How many hydrogen bond donors does this compound have?
0
COS(=O)(=O)[O-].C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1
Is there a black box warning associated with this drug?
No
COS(=O)(=O)[O-].C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1
How many heavy (non-hydrogen) atoms does this compound have?
21
COS(=O)(=O)[O-].C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1
How many aromatic rings does this compound have?
2
COS(=O)(=O)[O-].C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1
Is it known if this drug is the first approved in its class, regardless of the indication or route of administration, acting on a specific target?
No
COS(=O)(=O)[O-].C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1
What is the calculated ALogP value for this compound?
4.36
COS(=O)(=O)[O-].C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1
How many hydrogen bond acceptors does this compound have?
0
COS(=O)(=O)[O-].C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1
How many hydrogen bond donors are there in this compound, calculated according to Lipinski's original rules (i.e., counting NH and OH groups)?
0
COS(=O)(=O)[O-].C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1
Is this drug used for therapeutic purposes, rather than for imaging, additives, or other non-therapeutic applications?
Yes
COS(=O)(=O)[O-].C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1
Has this approved drug been withdrawn due to toxicity reasons for all indications, populations, and doses in at least one country (not necessarily the US)?
No
COS(=O)(=O)[O-].C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1
How many violations of Lipinski's Rule of Five (using HBA and HBD definitions) are there for this compound?
0
COS(=O)(=O)[O-].C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1
How many rotatable bonds does this compound have?
2
COS(=O)(=O)[O-].C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1
What is the first recorded year of approval for this drug?
1982
COS(=O)(=O)[O-].C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1
How many hydrogen bond acceptors are there in this compound, calculated according to Lipinski's original rules (i.e., counting N and O atoms)?
1
COS(=O)(=O)[O-].C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1
Is it known whether this drug is taken orally?
Yes
COS(=O)(=O)[O-].C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1
Is the drug administered in this specific form, such as a particular salt?
Yes
COS(=O)(=O)[O-].C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1
Determine if this compound is a prodrug.
No
COS(=O)(=O)[O-].C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1
Please provide a description of this drug's mechanism of action.
Muscarinic acetylcholine receptor M3 antagonist
COS(=O)(=O)[O-].C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1
What is the classification of this molecule? Please respond with Small Molecule, Protein, Antibody, Oligosaccharide, Oligonucleotide, Cell, Enzyme, Gene, or Unknown.
Small molecule
CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1.Cl
How many aromatic rings does this compound have?
0
CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1.Cl
Determine if this drug is administered as a racemic mixture, a single stereoisomer, an achiral molecule, or has an unknown chirality.
An achiral molecule
CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1.Cl
How many rotatable bonds does this compound have?
7
CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1.Cl
Does this compound satisfy the rule-of-three criteria?
No
CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1.Cl
How many hydrogen bond acceptors are there in this compound, calculated according to Lipinski's original rules (i.e., counting N and O atoms)?
3
CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1.Cl
How many violations of Lipinski's Rule of Five are there for this compound, using the HBA_LIPINSKI and HBD_LIPINSKI counts?
0
CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1.Cl
Is it known whether this drug is applied topically?
No
CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1.Cl
What is the molecular formula of this compound, including any salt that it may have?
C19H36ClNO2
CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1.Cl
Is this compound a small molecule polymer, such as polystyrene sulfonate?
No
CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1.Cl
Is this molecule characterized by a small molecular structure or a protein sequence?
It has a small molecule structure.
CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1.Cl
What is the first recorded year of approval for this drug?
1950
CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1.Cl
Is it known whether this drug is administered parenterally?
Yes
CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1.Cl
Please provide a description of this drug's mechanism of action.
Muscarinic acetylcholine receptor M1 antagonist
CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1.Cl
Determine if this molecule is inorganic, meaning it contains only metal atoms and fewer than two carbon atoms.
No
CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1.Cl
What is the highest development stage achieved for this compound across all indications? Please respond with Approved, Phase 3 Clinical Trials, Phase 2 Clinical Trials, Phase 1 Clinical Trials, Early Phase 1 Clinical Trials, or Clinical Phase Unknown.
Approved
CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1.Cl
How many hydrogen bond donors does this compound have?
0
CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1.Cl
Is there a black box warning associated with this drug?
No
CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1.Cl
Is it known if this drug is the first approved in its class, regardless of the indication or route of administration, acting on a specific target?
No
CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1.Cl
How many hydrogen bond acceptors does this compound have?
3
CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1.Cl
How many hydrogen bond donors are there in this compound, calculated according to Lipinski's original rules (i.e., counting NH and OH groups)?
0
CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1.Cl
Is this drug used for therapeutic purposes, rather than for imaging, additives, or other non-therapeutic applications?
Yes
CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1.Cl
What is the polar surface area (PSA) value of this compound?
29.54
CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1.Cl
Has this approved drug been withdrawn due to toxicity reasons for all indications, populations, and doses in at least one country (not necessarily the US)?
No
CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1.Cl
How many violations of Lipinski's Rule of Five (using HBA and HBD definitions) are there for this compound?
0
CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1.Cl
Determine the type of availability for this drug.
prescription only
CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1.Cl
What is the molecular weight of this compound's parent molecule?
309.49
CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1.Cl
Is this compound an acid, a base, or neutral?
BASE
CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1.Cl
Is it known whether this drug is taken orally?
Yes
CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1.Cl
Is the drug administered in this specific form, such as a particular salt?
Yes
CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1.Cl
Determine if this compound is a prodrug.
No
CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1.Cl
Please provide a description of this drug's mechanism of action.
Muscarinic acetylcholine receptor M3 antagonist
CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1.Cl
What is the calculated ALogP value for this compound?
4.4
CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1.Cl
What is the classification of this molecule? Please respond with Small Molecule, Protein, Antibody, Oligosaccharide, Oligonucleotide, Cell, Enzyme, Gene, or Unknown.
Small molecule
CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1.Cl
How many heavy (non-hydrogen) atoms does this compound have?
22
CC(C[N+](C)(C)C)OC(N)=O.[Cl-]
How many aromatic rings does this compound have?
0
CC(C[N+](C)(C)C)OC(N)=O.[Cl-]
What is the molecular formula of this compound, including any salt that it may have?
C7H17ClN2O2
CC(C[N+](C)(C)C)OC(N)=O.[Cl-]
How many violations of Lipinski's Rule of Five are there for this compound, using the HBA_LIPINSKI and HBD_LIPINSKI counts?
0
CC(C[N+](C)(C)C)OC(N)=O.[Cl-]
Determine if this drug is administered as a racemic mixture, a single stereoisomer, an achiral molecule, or has an unknown chirality.
Racemic mixture
CC(C[N+](C)(C)C)OC(N)=O.[Cl-]
Is it known whether this drug is applied topically?
No
CC(C[N+](C)(C)C)OC(N)=O.[Cl-]
Is this compound a small molecule polymer, such as polystyrene sulfonate?
No
CC(C[N+](C)(C)C)OC(N)=O.[Cl-]
Is this molecule characterized by a small molecular structure or a protein sequence?
It has a small molecule structure.
CC(C[N+](C)(C)C)OC(N)=O.[Cl-]
Please provide a description of this drug's mechanism of action.
Muscarinic acetylcholine receptor M2 agonist