AB77750
681136-29-8 | JNJ-1661010
Manufacturer: A2B Chem
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CatalogNumber
AB77750
ChemicalName
JNJ-1661010
CasNumber
681136-29-8
MolecularFormula
C19H19N5OS
MolecularWeight
365.4521
MdlNumber
MFCD00209157
Smiles
O=C(N1CCN(CC1)c1snc(n1)c1ccccc1)Nc1ccccc1
Complexity
459
Covalently-bondedUnitCount
1
HeavyAtomCount
26
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
3.5
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CatalogNumber: AB77750
ChemicalName: JNJ-1661010
CasNumber: 681136-29-8
MolecularFormula: C19H19N5OS
MolecularWeight: 365.4521
MdlNumber: MFCD00209157
Smiles: O=C(N1CCN(CC1)c1snc(n1)c1ccccc1)Nc1ccccc1
Complexity: 459
Covalently-bondedUnitCount: 1
HeavyAtomCount: 26
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 3.5
CatalogNumber:
AB77750
ChemicalName:
JNJ-1661010
CasNumber:
681136-29-8
MolecularFormula:
C19H19N5OS
MolecularWeight:
365.4521
MdlNumber:
MFCD00209157
Smiles:
O=C(N1CCN(CC1)c1snc(n1)c1ccccc1)Nc1ccccc1
Complexity:
459
Covalently-bondedUnitCount:
1
HeavyAtomCount:
26
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
3.5
CatalogNumber: AB77751
ChemicalName: 2-Phenylaminopyrimidine-5-boronic acid, pinacol ester
CasNumber: 956128-05-5
MolecularFormula: C16H20BN3O2
MolecularWeight: 297.1599
MdlNumber: MFCD12546565
Smiles: CC1(C)OB(OC1(C)C)c1cnc(nc1)Nc1ccccc1
Complexity: 362
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: __
CatalogNumber:
AB77751
ChemicalName:
2-Phenylaminopyrimidine-5-boronic acid, pinacol ester
CasNumber:
956128-05-5
MolecularFormula:
C16H20BN3O2
MolecularWeight:
297.1599
MdlNumber:
MFCD12546565
Smiles:
CC1(C)OB(OC1(C)C)c1cnc(nc1)Nc1ccccc1
Complexity:
362
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: c1ccc(cc1)Nc1c2ccccc2cc2c1cccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
c1ccc(cc1)Nc1c2ccccc2cc2c1cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: c1ccc(cc1)Nc1[nH]cnc2-c1ncn2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
c1ccc(cc1)Nc1[nH]cnc2-c1ncn2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__