AC58871
6964-62-1 | Nsc 66811
Manufacturer: A2B Chem
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CatalogNumber
AC58871
ChemicalName
Nsc 66811
CasNumber
6964-62-1
MolecularFormula
C23H20N2O
MolecularWeight
340.4177
MdlNumber
MFCD08823776
Smiles
Cc1ccc2c(n1)c(O)c(cc2)C(c1ccccc1)Nc1ccccc1
NscNumber
66811
Complexity
430
Covalently-bondedUnitCount
1
HeavyAtomCount
26
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
4
UndefinedAtomStereocenterCount
1
Xlogp3
5.4
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CatalogNumber: AC58871
ChemicalName: Nsc 66811
CasNumber: 6964-62-1
MolecularFormula: C23H20N2O
MolecularWeight: 340.4177
MdlNumber: MFCD08823776
Smiles: Cc1ccc2c(n1)c(O)c(cc2)C(c1ccccc1)Nc1ccccc1
NscNumber: 66811
Complexity: 430
Covalently-bondedUnitCount: 1
HeavyAtomCount: 26
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 4
UndefinedAtomStereocenterCount: 1
Xlogp3: 5.4
CatalogNumber:
AC58871
ChemicalName:
Nsc 66811
CasNumber:
6964-62-1
MolecularFormula:
C23H20N2O
MolecularWeight:
340.4177
MdlNumber:
MFCD08823776
Smiles:
Cc1ccc2c(n1)c(O)c(cc2)C(c1ccccc1)Nc1ccccc1
NscNumber:
66811
Complexity:
430
Covalently-bondedUnitCount:
1
HeavyAtomCount:
26
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
1
Xlogp3:
5.4
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Smiles: COc1ncc(c(n1)N)C#N
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Complexity: __
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RotatableBondCount: __
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Smiles:
COc1ncc(c(n1)N)C#N
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HeavyAtomCount:
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UndefinedAtomStereocenterCount:
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Smiles: NCc1cc(C)cc(c1)C
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Smiles:
NCc1cc(C)cc(c1)C
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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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UndefinedAtomStereocenterCount:
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Xlogp3:
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Smiles: OC(=O)[C@H](Cc1ccc(cc1F)O)N
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Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)[C@H](Cc1ccc(cc1F)O)N
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__