R,R-THC

Ligand Id: 2822
Ligand name R,R-THC

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 0
Hydrogen bond donors 2
Rotatable bonds 2
Topological polar surface area 40.46
Molecular weight 320.18
XLogP 6.64
No. Lipinski's rules broken 1

Molecular properties generated using the CDK


Classification
Compound class Synthetic organic
IUPAC Name
(5R,11R)-5,11-diethyl-5,6,11,12-tetrahydrochrysene-2,8-diol
Synonyms
cis-R,R-diethyl-tetrahydrochrysene-2,8-diol
Database Links
ChEMBL Ligand 103175, 130470, 230832, 262303
PubChem CID 446849
RCSB PDB Ligand ETC
Search Google for chemical match using the InChIKey MASYAWHPJCQLSW-ZIAGYGMSSA-N
Search Google for chemicals with the same backbone MASYAWHPJCQLSW
ZINC ZINC03940885