LOVASTATIN


SMILES CC[C@H](C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@H]21
InChIKey PCZOHLXUXFIOCF-BXMDZJJMSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 6
Molecular weight (Da) 404.3

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
NK2 NK2R Human Tachykinin A pKi 5.03 5.03 5.03 ChEMBL
A1 AA1R Human Adenosine A pKi 4.81 4.81 4.81 ChEMBL
NK2 NK2R Human Tachykinin A pKi 8.3 8.3 8.3 Drug Central
A1 AA1R Human Adenosine A pKi 8.32 8.32 8.32 Drug Central
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
NK2 NK2R Human Tachykinin A pIC50 4.55 4.55 4.55 ChEMBL
A1 AA1R Human Adenosine A pIC50 4.57 4.57 4.57 ChEMBL
TSH TSHR Human Glycoprotein hormone A Potency 4.4 4.4 4.4 ChEMBL
HCA2 HCAR2 Human Hydroxycarboxylic acid A pIC50 8.14 8.14 8.14 Drug Central
HCA3 HCAR3 Human Hydroxycarboxylic acid A pIC50 8.19 8.19 8.19 Drug Central