His-Leu-lopinavir

Ligand id: 9502

Name: His-Leu-lopinavir

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 14
Hydrogen bond donors 6
Rotatable bonds 29
Topological polar surface area 209.87
Molecular weight 906.54
XLogP 10.05
No. Lipinski's rules broken 4

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Synonyms
His-Leu-LPV | Histidine-Leucine-Lopinavir
Database Links
PubChem CID 124221655
Search Google for chemical match using the InChIKey CNRARJITWNMDCM-XGZCXRAPSA-N
Search Google for chemicals with the same backbone CNRARJITWNMDCM
Search UniChem for chemical match using the InChIKey CNRARJITWNMDCM-XGZCXRAPSA-N
Search UniChem for chemicals with the same backbone CNRARJITWNMDCM
Comments
A histidine based dipeptide prodrug of lopinavir (PubChem CID 92727). Lopinavir is an HIV protease inhibitor used in a fixed-dose combination with ritonavir. It is also an inhibitor of cytochrome P450 CYP3A.