AA26485
123447-62-1 | Prulifloxacin
Manufacturer: A2B Chem
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CatalogNumber
AA26485
ChemicalName
Prulifloxacin
CasNumber
123447-62-1
MolecularFormula
C21H20FN3O6S
MolecularWeight
461.4634
MdlNumber
MFCD00864847
Smiles
O=c1oc(c(o1)CN1CCN(CC1)c1cc2c(cc1F)c(=O)c(c1n2C(C)S1)C(=O)O)C
Complexity
931
Covalently-bondedUnitCount
1
HeavyAtomCount
32
HydrogenBondAcceptorCount
11
HydrogenBondDonorCount
1
RotatableBondCount
4
UndefinedAtomStereocenterCount
1
Xlogp3
1
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CatalogNumber: AA26485
ChemicalName: Prulifloxacin
CasNumber: 123447-62-1
MolecularFormula: C21H20FN3O6S
MolecularWeight: 461.4634
MdlNumber: MFCD00864847
Smiles: O=c1oc(c(o1)CN1CCN(CC1)c1cc2c(cc1F)c(=O)c(c1n2C(C)S1)C(=O)O)C
Complexity: 931
Covalently-bondedUnitCount: 1
HeavyAtomCount: 32
HydrogenBondAcceptorCount: 11
HydrogenBondDonorCount: 1
RotatableBondCount: 4
UndefinedAtomStereocenterCount: 1
Xlogp3: 1
CatalogNumber:
AA26485
ChemicalName:
Prulifloxacin
CasNumber:
123447-62-1
MolecularFormula:
C21H20FN3O6S
MolecularWeight:
461.4634
MdlNumber:
MFCD00864847
Smiles:
O=c1oc(c(o1)CN1CCN(CC1)c1cc2c(cc1F)c(=O)c(c1n2C(C)S1)C(=O)O)C
Complexity:
931
Covalently-bondedUnitCount:
1
HeavyAtomCount:
32
HydrogenBondAcceptorCount:
11
HydrogenBondDonorCount:
1
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
1
Xlogp3:
1
CatalogNumber: __
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MolecularWeight: __
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Smiles: OC(=O)C1(N)CC1(C)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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Smiles:
OC(=O)C1(N)CC1(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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Smiles: Oc1ccc2c(c1)n1ccccc1n2
Complexity: __
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HeavyAtomCount: __
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RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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Smiles:
Oc1ccc2c(c1)n1ccccc1n2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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Smiles: COc1ccccc1C(=O)N[C@H]1CN2CCC1CC2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccccc1C(=O)N[C@H]1CN2CCC1CC2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__