Lopinavir

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 187
Total Number of Articles : 268
PubChem 92727
Molecular Formula

C37H48N4O5

SMILES

CC1=C(C(=CC=C1)C)OCC(=O)N[C@@H](CC2=CC=CC=C2)[C@H](C[C@H](CC3=CC=CC=C3)NC(=O)[C@H](C(C)C)N4CCCNC4=O)O

InChI

InChI=1S/C37H48N4O5/c1-25(2)34(41-20-12-19-38-37(41)45)36(44)39-30(21-28-15-7-5-8-16-28)23-32(42)31(22-29-17-9-6-10-18-29)40-33(43)24-46-35-26(3)13-11-14-27(35)4/h5-11,13-18,25,30-32,34,42H,12,19-24H2,1-4H3,(H,38,45)(H,39,44)(H,40,43)/t30-,31-,32-,34-/m0/s1

synonyms
  • Lopinavir
  • 192725-17-0
  • Aluviran
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Properties
Property Value
MW 628.8 g/mol
HBD 4
HBA 5
Rotatable Bond Count 15
Exact Mass 628.36247064 g/mol
Monoisotopic Mass 628.36247064 g/mol
Heavy Atom Count 46
Isotope Atom Count 0
Atom Stereo Count 4
Covalent Unit Count 1
Complexity 940
xlogp 5.9
Topological Polar Surface Area 120