CAS Registry No. - 1256-86-6
ChEBI - CHEBI:41321
ChEMBL Ligand - CHEMBL1231592
PubChem CID - 65076
RCSB PDB Ligand - C3S&sid=1S0X
RCSB PDB Ligand - C3S
Molecular mass (Da) | 466.31168 |
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Polar surface area (A2) | 71.98 |
Lipinski rules broken | 1 |
logP | 9.221 |
Ligand type | Metabolite |
Radiolabelled | No |
Approved | No |
Approval Source |