AI55146
6981-18-6 | Ormetoprim
Manufacturer: A2B Chem
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CatalogNumber
AI55146
ChemicalName
Ormetoprim
CasNumber
6981-18-6
MolecularFormula
C14H18N4O2
MolecularWeight
274.3183
MdlNumber
MFCD00057747
Smiles
COc1cc(Cc2cnc(nc2N)N)c(cc1OC)C
NscNumber
95072
Complexity
305
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
2
RotatableBondCount
4
Xlogp3
1.2
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CatalogNumber: AI55146
ChemicalName: Ormetoprim
CasNumber: 6981-18-6
MolecularFormula: C14H18N4O2
MolecularWeight: 274.3183
MdlNumber: MFCD00057747
Smiles: COc1cc(Cc2cnc(nc2N)N)c(cc1OC)C
NscNumber: 95072
Complexity: 305
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 4
Xlogp3: 1.2
CatalogNumber:
AI55146
ChemicalName:
Ormetoprim
CasNumber:
6981-18-6
MolecularFormula:
C14H18N4O2
MolecularWeight:
274.3183
MdlNumber:
MFCD00057747
Smiles:
COc1cc(Cc2cnc(nc2N)N)c(cc1OC)C
NscNumber:
95072
Complexity:
305
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
4
Xlogp3:
1.2
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCC[C@H](c1cccc(c1)C)N.Cl
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
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MolecularFormula:
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Smiles:
CCC[C@H](c1cccc(c1)C)N.Cl
NscNumber:
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Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
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MolecularFormula: __
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Smiles: O=C([C@@H](NC(=O)OC(C)(C)C)CCC(=O)OC(C)(C)C)Oc1ccc(cc1)[N+](=O)[O-]
NscNumber: __
Complexity: __
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HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
O=C([C@@H](NC(=O)OC(C)(C)C)CCC(=O)OC(C)(C)C)Oc1ccc(cc1)[N+](=O)[O-]
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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:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc2c(c1)OCC(=O)N2O
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc2c(c1)OCC(=O)N2O
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__