Ligand Data

Ligand

id 101941
Name CHEMBL3263322
SMILES CC(C)OC1=C(C=C(C=C1)N2CCN(CC2)CC3=CC=C(C=C3)N(C)C)NC(=O)C4=NC=CN=C4
InChIKey AGESNOWGWUMTQX-UHFFFAOYSA-N
Type small molecule
External Links

Structure

Properties

Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 8
Molecular weight 474.6


Bioactivity

Receptor Affinity (nM) Potency (nM)
GTP Uniprot Species Family Class Min Avg Max Min Avg Max
CCR5 ccr5_human Human Chemokine receptors Class A (Rhodopsin) 28100.0 28100.0 28100.0