Unc9975


SMILES O=C1CCc2c(N1)nc(cc2)OCCCCN1CCCN(CC1)c1cccc(c1Cl)Cl
InChIKey JQSRFMXTGAVHIR-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 7
Molecular weight (Da) 462.2

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Bioactivity

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D2 DRD2 Human Dopamine A pEC50 8.96 8.96 8.96 Guide to Pharmacology
D2 DRD2 Human Dopamine A pKi 8.59 8.59 8.59 Guide to Pharmacology
D5 DRD5 Human Dopamine A pKi 6.29 6.29 6.29 ChEMBL
5-HT2B 5HT2B Human 5-Hydroxytryptamine A pKi 8.96 8.96 8.96 ChEMBL
D1 DRD1 Human Dopamine A pKi 5.98 5.98 5.98 ChEMBL
D4 DRD4 Human Dopamine A pKi 6.75 6.75 6.75 ChEMBL
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pKi 7.0 7.0 7.0 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 7.54 7.54 7.54 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pEC50 5.75 5.75 5.75 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 8.13 8.13 8.13 ChEMBL
D3 DRD3 Human Dopamine A pKi 7.96 7.96 7.96 ChEMBL
D2 DRD2 Human Dopamine A pEC50 7.89 8.39 8.8 ChEMBL
D2 DRD2 Human Dopamine A pKi 8.59 8.81 8.92 ChEMBL