AI33283
1379181-19-7 | 1-(Carboxymethyl)-2-oxo-1,2-dihydropyridine-3-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AI33283
ChemicalName
1-(Carboxymethyl)-2-oxo-1,2-dihydropyridine-3-carboxylic acid
CasNumber
1379181-19-7
MolecularFormula
C8H7NO5
MolecularWeight
197.1449
MdlNumber
MFCD20646967
Smiles
OC(=O)Cn1cccc(c1=O)C(=O)O
Complexity
355
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
3
Xlogp3
0.3
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CatalogNumber: AI33283
ChemicalName: 1-(Carboxymethyl)-2-oxo-1,2-dihydropyridine-3-carboxylic acid
CasNumber: 1379181-19-7
MolecularFormula: C8H7NO5
MolecularWeight: 197.1449
MdlNumber: MFCD20646967
Smiles: OC(=O)Cn1cccc(c1=O)C(=O)O
Complexity: 355
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: 0.3
CatalogNumber:
AI33283
ChemicalName:
1-(Carboxymethyl)-2-oxo-1,2-dihydropyridine-3-carboxylic acid
CasNumber:
1379181-19-7
MolecularFormula:
C8H7NO5
MolecularWeight:
197.1449
MdlNumber:
MFCD20646967
Smiles:
OC(=O)Cn1cccc(c1=O)C(=O)O
Complexity:
355
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
0.3
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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Smiles: NC1CCc2c(C1)sc(n2)Br
Complexity: __
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Smiles:
NC1CCc2c(C1)sc(n2)Br
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Smiles: [O-][N+](=O)c1ccnc(c1Br)Cl
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Smiles:
[O-][N+](=O)c1ccnc(c1Br)Cl
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Smiles: CCOc1ccc(cc1Cl)C(F)(F)F
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Smiles:
CCOc1ccc(cc1Cl)C(F)(F)F
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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