AD22423
483367-10-8 | Purmorphamine
Manufacturer: A2B Chem
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CatalogNumber
AD22423
ChemicalName
Purmorphamine
CasNumber
483367-10-8
MolecularFormula
C31H32N6O2
MolecularWeight
520.6248
MdlNumber
MFCD09037557
Smiles
C1CCC(CC1)n1cnc2c1nc(nc2Nc1ccc(cc1)N1CCOCC1)Oc1cccc2c1cccc2
NscNumber
747596
Complexity
768
Covalently-bondedUnitCount
1
HeavyAtomCount
39
HydrogenBondAcceptorCount
7
HydrogenBondDonorCount
1
RotatableBondCount
6
Xlogp3
6.5
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CatalogNumber: AD22423
ChemicalName: Purmorphamine
CasNumber: 483367-10-8
MolecularFormula: C31H32N6O2
MolecularWeight: 520.6248
MdlNumber: MFCD09037557
Smiles: C1CCC(CC1)n1cnc2c1nc(nc2Nc1ccc(cc1)N1CCOCC1)Oc1cccc2c1cccc2
NscNumber: 747596
Complexity: 768
Covalently-bondedUnitCount: 1
HeavyAtomCount: 39
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 1
RotatableBondCount: 6
Xlogp3: 6.5
CatalogNumber:
AD22423
ChemicalName:
Purmorphamine
CasNumber:
483367-10-8
MolecularFormula:
C31H32N6O2
MolecularWeight:
520.6248
MdlNumber:
MFCD09037557
Smiles:
C1CCC(CC1)n1cnc2c1nc(nc2Nc1ccc(cc1)N1CCOCC1)Oc1cccc2c1cccc2
NscNumber:
747596
Complexity:
768
Covalently-bondedUnitCount:
1
HeavyAtomCount:
39
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
1
RotatableBondCount:
6
Xlogp3:
6.5
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Smiles: N#Cc1cc2cc(C)ccc2nc1Cl
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Complexity: __
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Smiles:
N#Cc1cc2cc(C)ccc2nc1Cl
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Smiles: On1ccc(=N)c(c1)C
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Smiles:
On1ccc(=N)c(c1)C
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RotatableBondCount:
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Smiles: COc1c(OC)ccc2c1CN1CCc3c(C1=C2)cc1c(c3)OCO1
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Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
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Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1c(OC)ccc2c1CN1CCc3c(C1=C2)cc1c(c3)OCO1
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__