AA56740
1380672-07-0 | G007-LK
Manufacturer: A2B Chem
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CatalogNumber
AA56740
ChemicalName
G007-LK
CasNumber
1380672-07-0
MolecularFormula
C25H16ClN7O3S
MolecularWeight
529.9576
MdlNumber
MFCD28167833
Smiles
N#Cc1ccc(cc1)c1nnc(o1)/C=C/c1nnc(n1c1ccccc1Cl)c1ccc(cn1)S(=O)(=O)C
Complexity
961
Covalently-bondedUnitCount
1
DefinedBondStereocenterCount
1
HeavyAtomCount
37
HydrogenBondAcceptorCount
9
RotatableBondCount
6
Xlogp3
3.1
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CatalogNumber: AA56740
ChemicalName: G007-LK
CasNumber: 1380672-07-0
MolecularFormula: C25H16ClN7O3S
MolecularWeight: 529.9576
MdlNumber: MFCD28167833
Smiles: N#Cc1ccc(cc1)c1nnc(o1)/C=C/c1nnc(n1c1ccccc1Cl)c1ccc(cn1)S(=O)(=O)C
Complexity: 961
Covalently-bondedUnitCount: 1
DefinedBondStereocenterCount: 1
HeavyAtomCount: 37
HydrogenBondAcceptorCount: 9
RotatableBondCount: 6
Xlogp3: 3.1
CatalogNumber:
AA56740
ChemicalName:
G007-LK
CasNumber:
1380672-07-0
MolecularFormula:
C25H16ClN7O3S
MolecularWeight:
529.9576
MdlNumber:
MFCD28167833
Smiles:
N#Cc1ccc(cc1)c1nnc(o1)/C=C/c1nnc(n1c1ccccc1Cl)c1ccc(cn1)S(=O)(=O)C
Complexity:
961
Covalently-bondedUnitCount:
1
DefinedBondStereocenterCount:
1
HeavyAtomCount:
37
HydrogenBondAcceptorCount:
9
RotatableBondCount:
6
Xlogp3:
3.1
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Smiles: OCC(C(N1CCN(CCN(CCN(CC1)C(=O)[O-])C(=O)[O-])C(=O)[O-])CO)O.[Ga+3]
Complexity: __
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Smiles:
OCC(C(N1CCN(CCN(CCN(CC1)C(=O)[O-])C(=O)[O-])C(=O)[O-])CO)O.[Ga+3]
Complexity:
__
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: __
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DefinedBondStereocenterCount: __
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HydrogenBondAcceptorCount: __
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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:
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Complexity:
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Covalently-bondedUnitCount:
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DefinedBondStereocenterCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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