Ligand Data

Ligand

id 72573
Name CHEMBL196813
SMILES COC(=O)NCc1ccc2c(c1)CC[C@@H](C(=O)N(C)[C@H](CN1CC[C@H](O)C1)c1ccccc1)O2
InChIKey PNDTYSVYFUUGGI-ZDXQCDESSA-N
Type small-molecule
External Links

Structure

Properties

Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 7
Molecular weight 467.2


Bioactivity

Receptor Affinity (nM) Potency (nM)
GTP Uniprot Species Family Class Min Avg Max Min Avg Max