compound 4 [PMID: 30824200]


SMILES CCc1cc(O)cc2c1[nH]cc2/C=N/NC(=N)NCCc1ccc(cc1)C
InChIKey FEOVKCUPOVFERI-DHRITJCHSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 5
Rotatable bonds 6
Molecular weight (Da) 363.2

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pKi 8.52 8.52 8.52 ChEMBL
D2 DRD2 Rat Dopamine A pKi 6.99 7.39 7.8 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database