CHEMBL4521971


SMILES Clc1cc2c(NC3CCCC3)nnc(-c3ccncc3)c2cc1Cl
InChIKey ABGOSOMRWSYAOB-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 3
Molecular weight (Da) 358.1

Drug properties

Molecular type Unknown
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
NK2 NK2R Human Tachykinin A pKi 5.39 5.39 5.39 ChEMBL
δ OPRD Human Opioid A pKi 5.05 5.05 5.05 ChEMBL
A3 AA3R Human Adenosine A pKi 5.7 5.7 5.7 ChEMBL
A1 AA1R Human Adenosine A pKi 7.68 7.8 7.92 ChEMBL
A2A AA2AR Human Adenosine A pKi 7.55 7.55 7.55 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database