AG46832
5435-40-5 | (2,5-Dimethyl-1h-indol-3-yl)acetic acid
Manufacturer: A2B Chem
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CatalogNumber
AG46832
ChemicalName
(2,5-Dimethyl-1h-indol-3-yl)acetic acid
CasNumber
5435-40-5
MolecularFormula
C12H13NO2
MolecularWeight
203.2371
MdlNumber
MFCD02664400
Smiles
Cc1c(CC(=O)O)c2c([nH]1)ccc(c2)C
NscNumber
21431
Complexity
254
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
2.3
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CatalogNumber: AG46832
ChemicalName: (2,5-Dimethyl-1h-indol-3-yl)acetic acid
CasNumber: 5435-40-5
MolecularFormula: C12H13NO2
MolecularWeight: 203.2371
MdlNumber: MFCD02664400
Smiles: Cc1c(CC(=O)O)c2c([nH]1)ccc(c2)C
NscNumber: 21431
Complexity: 254
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 2.3
CatalogNumber:
AG46832
ChemicalName:
(2,5-Dimethyl-1h-indol-3-yl)acetic acid
CasNumber:
5435-40-5
MolecularFormula:
C12H13NO2
MolecularWeight:
203.2371
MdlNumber:
MFCD02664400
Smiles:
Cc1c(CC(=O)O)c2c([nH]1)ccc(c2)C
NscNumber:
21431
Complexity:
254
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
2.3
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Smiles: CN(/N=N/c1ccc(cc1)S(=O)(=O)N)C
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CN(/N=N/c1ccc(cc1)S(=O)(=O)N)C
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Smiles: O=C(c1ccc2c(c1)cccc2)CCNc1ccc(c(c1)C)C
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Smiles:
O=C(c1ccc2c(c1)cccc2)CCNc1ccc(c(c1)C)C
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Smiles: ClC(C(=O)OC(C)(C)C)Cl
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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ChemicalName:
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CasNumber:
__
MolecularFormula:
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MolecularWeight:
__
MdlNumber:
__
Smiles:
ClC(C(=O)OC(C)(C)C)Cl
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
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