AB15184
188591-46-0 | Gsk3787
Manufacturer: A2B Chem
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CatalogNumber
AB15184
ChemicalName
Gsk3787
CasNumber
188591-46-0
MolecularFormula
C15H12ClF3N2O3S
MolecularWeight
392.7806
MdlNumber
MFCD00099612
Smiles
Clc1ccc(cc1)C(=O)NCCS(=O)(=O)c1ccc(cn1)C(F)(F)F
Complexity
557
Covalently-bondedUnitCount
1
HeavyAtomCount
25
HydrogenBondAcceptorCount
7
HydrogenBondDonorCount
1
RotatableBondCount
5
Xlogp3
2.9
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CatalogNumber: AB15184
ChemicalName: Gsk3787
CasNumber: 188591-46-0
MolecularFormula: C15H12ClF3N2O3S
MolecularWeight: 392.7806
MdlNumber: MFCD00099612
Smiles: Clc1ccc(cc1)C(=O)NCCS(=O)(=O)c1ccc(cn1)C(F)(F)F
Complexity: 557
Covalently-bondedUnitCount: 1
HeavyAtomCount: 25
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 1
RotatableBondCount: 5
Xlogp3: 2.9
CatalogNumber:
AB15184
ChemicalName:
Gsk3787
CasNumber:
188591-46-0
MolecularFormula:
C15H12ClF3N2O3S
MolecularWeight:
392.7806
MdlNumber:
MFCD00099612
Smiles:
Clc1ccc(cc1)C(=O)NCCS(=O)(=O)c1ccc(cn1)C(F)(F)F
Complexity:
557
Covalently-bondedUnitCount:
1
HeavyAtomCount:
25
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
1
RotatableBondCount:
5
Xlogp3:
2.9
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Smiles: CCCCCC1OC1/C=C/C=O
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Smiles:
CCCCCC1OC1/C=C/C=O
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: Clc1ccc(cc1)OCC(=O)c1ccccc1
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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CatalogNumber:
__
ChemicalName:
__
CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
Clc1ccc(cc1)OCC(=O)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
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