CHEMBL4853772


SMILES Cc1nc(N)sc1CCCN/C(N)=N/C(=S)N[C@H](C)c1ccccc1
InChIKey GUTIIYCXIXRNPB-LLVKDONJSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 4
Rotatable bonds 6
Molecular weight (Da) 376.2

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Sankey plot

Compound is not listed as a drug.

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
H4 HRH4 Human Histamine A pKi 4.57 4.57 4.57 ChEMBL
H2 HRH2 Human Histamine A pKi 6.94 6.94 6.94 ChEMBL
H3 HRH3 Human Histamine A pKi 4.19 4.19 4.19 ChEMBL
D3 DRD3 Human Dopamine A pKi 7.22 7.22 7.22 ChEMBL
D2 DRD2 Human Dopamine A pKi 5.93 5.93 5.93 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
H2 HRH2 Human Histamine A pEC50 6.43 6.43 6.43 ChEMBL
D3 DRD3 Human Dopamine A pEC50 6.78 6.78 6.78 ChEMBL
D2 DRD2 Human Dopamine A pEC50 5.82 5.82 5.82 ChEMBL