AA47087
13228-40-5 | 2-(2-Pyridinyl)-1H-indole
Manufacturer: A2B Chem
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CatalogNumber
AA47087
ChemicalName
2-(2-Pyridinyl)-1H-indole
CasNumber
13228-40-5
MolecularFormula
C13H10N2
MolecularWeight
194.2319
MdlNumber
MFCD00033466
Smiles
c1ccc(nc1)c1cc2c([nH]1)cccc2
NscNumber
112668
Complexity
217
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
1
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
3.3
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CatalogNumber: AA47087
ChemicalName: 2-(2-Pyridinyl)-1H-indole
CasNumber: 13228-40-5
MolecularFormula: C13H10N2
MolecularWeight: 194.2319
MdlNumber: MFCD00033466
Smiles: c1ccc(nc1)c1cc2c([nH]1)cccc2
NscNumber: 112668
Complexity: 217
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 3.3
CatalogNumber:
AA47087
ChemicalName:
2-(2-Pyridinyl)-1H-indole
CasNumber:
13228-40-5
MolecularFormula:
C13H10N2
MolecularWeight:
194.2319
MdlNumber:
MFCD00033466
Smiles:
c1ccc(nc1)c1cc2c([nH]1)cccc2
NscNumber:
112668
Complexity:
217
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
3.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCn1c(cc2c1cccc2)c1ccccc1
NscNumber: __
Complexity: 244
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 4
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MolecularFormula:
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Smiles:
CCn1c(cc2c1cccc2)c1ccccc1
NscNumber:
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Complexity:
244
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
4
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Smiles: OC(=O)COc1cc(ccc1N(CC(=O)O)CC(=O)O)c1[nH]c2c(c1)ccc(c2)C(=O)[O-].[K+].[K+].[K+].[K+]
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Smiles:
OC(=O)COc1cc(ccc1N(CC(=O)O)CC(=O)O)c1[nH]c2c(c1)ccc(c2)C(=O)[O-].[K+].[K+].[K+].[K+]
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Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
__
RotatableBondCount:
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Xlogp3:
__
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Smiles: COc1ccc2c(c1)cc1-c3cccc4c3c(-c1n2)ccc4
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc2c(c1)cc1-c3cccc4c3c(-c1n2)ccc4
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__