AI44534
202584-21-2 | 6-(Methylsulfanyl)-1h-indole-2-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AI44534
ChemicalName
6-(Methylsulfanyl)-1h-indole-2-carboxylic acid
CasNumber
202584-21-2
MolecularFormula
C10H9NO2S
MolecularWeight
207.249
MdlNumber
MFCD02664463
Smiles
CSc1ccc2c(c1)[nH]c(c2)C(=O)O
Complexity
234
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
2.8
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CatalogNumber: AI44534
ChemicalName: 6-(Methylsulfanyl)-1h-indole-2-carboxylic acid
CasNumber: 202584-21-2
MolecularFormula: C10H9NO2S
MolecularWeight: 207.249
MdlNumber: MFCD02664463
Smiles: CSc1ccc2c(c1)[nH]c(c2)C(=O)O
Complexity: 234
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 2.8
CatalogNumber:
AI44534
ChemicalName:
6-(Methylsulfanyl)-1h-indole-2-carboxylic acid
CasNumber:
202584-21-2
MolecularFormula:
C10H9NO2S
MolecularWeight:
207.249
MdlNumber:
MFCD02664463
Smiles:
CSc1ccc2c(c1)[nH]c(c2)C(=O)O
Complexity:
234
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
2.8
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Smiles: CCOC(=O)c1cnc2c(c1)ccc(c2)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
CCOC(=O)c1cnc2c(c1)ccc(c2)O
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Smiles: Nc1ccc(cc1)Cl.Cl
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Smiles:
Nc1ccc(cc1)Cl.Cl
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RotatableBondCount:
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Smiles: Nc1scc(n1)c1cccc(c1)OCc1ccccc1.Br
Complexity: __
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HeavyAtomCount: __
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HydrogenBondDonorCount: __
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Xlogp3: __
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__
ChemicalName:
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CasNumber:
__
MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
Nc1scc(n1)c1cccc(c1)OCc1ccccc1.Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__