AB63074
442562-80-3 | 3-(1H-Indol-4-yl)benzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AB63074
ChemicalName
3-(1H-Indol-4-yl)benzoic acid
CasNumber
442562-80-3
MolecularFormula
C15H11NO2
MolecularWeight
237.2533
MdlNumber
MFCD13177530
Smiles
OC(=O)c1cccc(c1)c1cccc2c1cc[nH]2
Complexity
318
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
3.2
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CatalogNumber: AB63074
ChemicalName: 3-(1H-Indol-4-yl)benzoic acid
CasNumber: 442562-80-3
MolecularFormula: C15H11NO2
MolecularWeight: 237.2533
MdlNumber: MFCD13177530
Smiles: OC(=O)c1cccc(c1)c1cccc2c1cc[nH]2
Complexity: 318
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 3.2
CatalogNumber:
AB63074
ChemicalName:
3-(1H-Indol-4-yl)benzoic acid
CasNumber:
442562-80-3
MolecularFormula:
C15H11NO2
MolecularWeight:
237.2533
MdlNumber:
MFCD13177530
Smiles:
OC(=O)c1cccc(c1)c1cccc2c1cc[nH]2
Complexity:
318
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
3.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1cccc(c1)c1ccc2c(c1)cc[nH]2
Complexity: 318
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3.5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1cccc(c1)c1ccc2c(c1)cc[nH]2
Complexity:
318
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1cccc(c1)c1nnn[nH]1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
Nc1cccc(c1)c1nnn[nH]1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1cccc(c1)c1nnn[nH]1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1cccc(c1)c1nnn[nH]1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__