ZK159222

Ligand Id: 2789
Ligand name ZK159222

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 3
Rotatable bonds 10
Topological polar surface area 86.99
Molecular weight 512.35
XLogP 6.45
No. Lipinski's rules broken 1

Molecular properties generated using the CDK


Classification
Compound class Synthetic organic
IUPAC Name
butyl 1-[(E,1R,4R)-4-[(1R,3aS,4E,7aR)-4-[(2Z)-2-[(3S,5R)-3,5-dihydroxy-2-methylidenecyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-1-hydroxypent-2-enyl]cyclopropane-1-carboxylate
Synonyms
C410228
Database Links
PubChem CID 9936230
Search Google for chemical match using the InChIKey SPARTCPUGRJFRS-PBDCIXLPSA-N
Search Google for chemicals with the same backbone SPARTCPUGRJFRS
ZINC ZINC65731636