Ligand Data

Ligand

id 136879
Name CHEMBL3735910
SMILES CCCc1nc2c(C)cc(C(=O)N[C@@H](C)c3ccccc3)cc2n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1
InChIKey JBQLJPNVSMAEBZ-QHCPKHFHSA-N
Type small-molecule
External Links

Structure

Properties

Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 9
Molecular weight 555.3


Bioactivity

Receptor Affinity (nM) Potency (nM)
GTP Uniprot Species Family Class Min Avg Max Min Avg Max
AT1 AGTR1 Human Angiotensin A (Rhodopsin) 1534 1534 1534