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Lopinavir


  • SKU Code: CH136963
Chemical Name - Lopinavir
Mol Weight - 628.811
Smiles - CC(C)[C@@H](C(N[C@H](C[C@@H]([C@H](Cc1ccccc1)NC(COc1c(C)cccc1C)=O)O)Cc1ccccc1)=O)N(CCCN1)C1=O
Property Name Property Value
Mol NameLopinavir
Molweight628.811
Monoisotopic Mass628.362471
Clogp4.847
Clogs-6.131
H Acceptors9
H Donors4
Total Surface Area501.42
Relative Psa0.19973
Polar Surface Area120
Druglikeness6.5929
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritanthigh
Shape Index0.41304
Molecular Flexibility0.50416
Molecular Complexity0.84284
Fragments1
Non H Atoms46
Non Ch Atoms9
Electronegative Atoms9
Stereo Centers4
Rotatable Bonds15
Rings Closures4
Small Rings4
Aromatic Rings3
Aromatic Atoms18
Sp3 Atoms18
Symmetric Atoms8
Amides4
SmilesCC(C)[C@@H](C(N[C@H](C[C@@H]([C@H](Cc1ccccc1)NC(COc1c(C)cccc1C)=O)O)Cc1ccccc1)=O)N(CCCN1)C1=O
InChIC37H48N4O5

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