AD56226
13368-14-4 | 2-Chloro-1h-purin-6(7h)-one
Manufacturer: A2B Chem
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CatalogNumber
AD56226
ChemicalName
2-Chloro-1h-purin-6(7h)-one
CasNumber
13368-14-4
MolecularFormula
C5H3ClN4O
MolecularWeight
170.5565
MdlNumber
MFCD00127838
Smiles
ClC1NC(=O)C2=NC=NC2=N1
NscNumber
12159
Complexity
229
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
Xlogp3
0.6
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CatalogNumber: AD56226
ChemicalName: 2-Chloro-1h-purin-6(7h)-one
CasNumber: 13368-14-4
MolecularFormula: C5H3ClN4O
MolecularWeight: 170.5565
MdlNumber: MFCD00127838
Smiles: ClC1NC(=O)C2=NC=NC2=N1
NscNumber: 12159
Complexity: 229
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
Xlogp3: 0.6
CatalogNumber:
AD56226
ChemicalName:
2-Chloro-1h-purin-6(7h)-one
CasNumber:
13368-14-4
MolecularFormula:
C5H3ClN4O
MolecularWeight:
170.5565
MdlNumber:
MFCD00127838
Smiles:
ClC1NC(=O)C2=NC=NC2=N1
NscNumber:
12159
Complexity:
229
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
Xlogp3:
0.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: C[n+]1c2ccccc2cc2c1cccc2
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
C[n+]1c2ccccc2cc2c1cccc2
NscNumber:
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Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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Xlogp3:
__
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ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCC#Cc1ccc(s1)C=O
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Xlogp3: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
OCC#Cc1ccc(s1)C=O
NscNumber:
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Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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Xlogp3:
__
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MolecularFormula: __
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Smiles: NCCCCNC(C)(C)C
NscNumber: __
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NCCCCNC(C)(C)C
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
__