CHEMBL4853668


SMILES CCCCCCNC(=O)/N=C(\N)NCCCc1sc(N)nc1C
InChIKey CKIPXVNSJRXNTQ-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 4
Rotatable bonds 9
Molecular weight (Da) 340.2

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
H4 HRH4 Human Histamine A pKi 5.09 5.09 5.09 ChEMBL
H2 HRH2 Human Histamine A pKi 7.54 7.54 7.54 ChEMBL
H1 HRH1 Human Histamine A pKi 5.11 5.11 5.11 ChEMBL
H3 HRH3 Human Histamine A pKi 5.25 5.25 5.25 ChEMBL
D3 DRD3 Human Dopamine A pKi 7.85 7.85 7.85 ChEMBL
D2 DRD2 Human Dopamine A pKi 6.25 6.25 6.25 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
H2 HRH2 Human Histamine A pEC50 7.07 7.24 7.41 ChEMBL
D3 DRD3 Human Dopamine A pEC50 7.63 7.63 7.63 ChEMBL
D2 DRD2 Human Dopamine A pEC50 5.76 5.76 5.76 ChEMBL