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Chem Lercanidipine | Cheminformatics

Lercanidipine


  • SKU Code: CH136962
Chemical Name - Lercanidipine
Mol Weight - 611.737
Smiles - CC(C)(CN(C)CCC(c1ccccc1)c1ccccc1)OC(C(C1c2cccc([N+]([O-])=O)c2)=C(C)NC(C)=C1C(OC)=O)=O
Property Name Property Value
Mol NameLercanidipine
Molweight611.737
Monoisotopic Mass611.299537
Clogp4.7102
Clogs-5.996
H Acceptors9
H Donors1
Total Surface Area476.3
Relative Psa0.19213
Polar Surface Area113.69
Druglikeness-2.5904
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Shape Index0.42222
Molecular Flexibility0.54088
Molecular Complexity0.89035
Fragments1
Non H Atoms45
Non Ch Atoms9
Electronegative Atoms9
Stereo Centers1
Rotatable Bonds14
Rings Closures4
Small Rings4
Aromatic Rings3
Aromatic Atoms18
Sp3 Atoms16
Symmetric Atoms9
Amines1
Alkyl Amines1
Basic Nitrogens1
Acidic Oxygens1
SmilesCC(C)(CN(C)CCC(c1ccccc1)c1ccccc1)OC(C(C1c2cccc([N+]([O-])=O)c2)=C(C)NC(C)=C1C(OC)=O)=O
InChIKey
InChIC36H41N3O6

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