Ligand Data

Ligand

id 46070
Name CHEMBL1080683
SMILES CC1=C(C=C(N1C)C2=CC=CC=C2)C(=O)NCCN3CCN(CC3)C4=C(C(=CC=C4)Cl)Cl
InChIKey SUYPLBXTJNBFTI-UHFFFAOYSA-N
Type small molecule
External Links

Structure

Properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 6
Molecular weight 471.4


Bioactivity

Receptor Affinity (nM) Potency (nM)
GTP Uniprot Species Family Class Min Avg Max Min Avg Max
5-HT2A 5ht2a_human Human 5-Hydroxytryptamine receptors Class A (Rhodopsin) 175.0 175.0 175.0
5-HT2C 5ht2c_human Human 5-Hydroxytryptamine receptors Class A (Rhodopsin) 156.0 156.0 156.0