molindone


SMILES CCc1c(C)[nH]c2c1C(=O)C(CC2)CN1CCOCC1
InChIKey KLPWJLBORRMFGK-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 3
Molecular weight (Da) 276.2

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug Yes

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 6.5 6.5 6.5 Guide to Pharmacology
H1 HRH1 Human Histamine A pKi 5.0 5.17 5.67 PDSP Ki database
H1 HRH1 Human Histamine A pKi 5.7 5.7 5.7 Guide to Pharmacology
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 8.27 8.27 8.27 Drug Central
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 5.42 5.51 5.6 PDSP Ki database
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 8.19 8.19 8.19 Drug Central
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 5.22 5.42 6.49 PDSP Ki database
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pKi 8.3 8.3 8.3 Drug Central
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pKi 5.0 5.0 5.0 PDSP Ki database
5-HT6 5HT6R Human 5-Hydroxytryptamine A pKi 8.22 8.22 8.22 Drug Central
5-HT6 5HT6R Human 5-Hydroxytryptamine A pKi 6.0 6.0 6.0 PDSP Ki database
5-HT7 5HT7R Human 5-Hydroxytryptamine A pKi 8.18 8.18 8.18 Drug Central
5-HT7 5HT7R Human 5-Hydroxytryptamine A pKi 5.52 5.52 5.52 PDSP Ki database
5-HT7 5HT7R Human 5-Hydroxytryptamine A pKi 6.58 6.58 6.58 ChEMBL
M1 ACM1 Human Acetylcholine (muscarinic) A pKi 3.55 3.55 3.55 PDSP Ki database
M2 ACM2 Human Acetylcholine (muscarinic) A pKi 3.35 3.35 3.35 PDSP Ki database
M3 ACM3 Human Acetylcholine (muscarinic) A pKi 8.3 8.3 8.3 Drug Central
M3 ACM3 Human Acetylcholine (muscarinic) A pKi 5.0 5.0 5.0 PDSP Ki database
α1A ADA1A Human Adrenoceptors A pKi 8.25 8.25 8.25 Drug Central
α1D ADA1D Human Adrenoceptors A pKi 5.58 5.58 5.58 PDSP Ki database
α2A ADA2A Human Adrenoceptors A pKi 8.22 8.22 8.22 Drug Central
α2A ADA2A Human Adrenoceptors A pKi 5.96 5.96 5.96 PDSP Ki database
α2B ADA2B Human Adrenoceptors A pKi 8.2 8.2 8.2 Drug Central
α2B ADA2B Human Adrenoceptors A pKi 6.25 6.25 6.25 PDSP Ki database
α2C ADA2C Human Adrenoceptors A pKi 8.17 8.17 8.17 Drug Central
α2C ADA2C Human Adrenoceptors A pKi 6.76 6.76 6.76 PDSP Ki database
D2 DRD2 Human Dopamine A pKi 6.92 7.74 8.42 PDSP Ki database
D3 DRD3 Human Dopamine A pKi 8.13 8.13 8.13 Drug Central
D3 DRD3 Human Dopamine A pKi 7.03 7.39 7.7 PDSP Ki database
D4 DRD4 Human Dopamine A pKi 8.25 8.25 8.25 Drug Central
D4 DRD4 Human Dopamine A pKi 5.37 5.99 8.25 PDSP Ki database
H1 HRH1 Human Histamine A pKi 8.24 8.24 8.24 Drug Central
5-HT6 5HT6R Rat 5-Hydroxytryptamine A pKi 5.3 5.3 5.3 PDSP Ki database
5-HT2A 5HT2A Rat 5-Hydroxytryptamine A pKi 8.23 8.23 8.23 Drug Central
5-HT2C 5HT2C Rat 5-Hydroxytryptamine A pKi 5.0 5.0 5.0 PDSP Ki database
D2 DRD2 Mouse Dopamine A pKi 7.25 7.25 7.25 PDSP Ki database
D1 DRD1 Bovine Dopamine A pKi 5.0 5.0 5.0 PDSP Ki database
D2 DRD2 Bovine Dopamine A pKi 7.05 7.12 7.19 PDSP Ki database
D1 DRD1 Rat Dopamine A pKi 8.24 8.24 8.24 Drug Central
D1 DRD1 Rat Dopamine A pKi 5.8 5.8 5.8 ChEMBL
5-HT7 5HT7R Rat 5-Hydroxytryptamine A pKi 6.58 6.58 6.58 PDSP Ki database
D2 DRD2 Rat Dopamine A pKi 8.13 8.13 8.13 Drug Central
D2 DRD2 Rat Dopamine A pKi 7.8 7.8 7.8 PDSP Ki database
D2 DRD2 Rat Dopamine A pKi 7.48 7.48 7.48 ChEMBL
D1 DRD1 Mouse Dopamine A pKi 5.0 5.0 5.0 PDSP Ki database
M3 ACM3 Rat Acetylcholine (muscarinic) A pKi 5.0 5.0 5.0 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D2 DRD2 Human Dopamine A pIC50 8.21 8.21 8.21 Drug Central
M1 ACM1 Rat Acetylcholine (muscarinic) A Potency 4.55 4.55 4.55 ChEMBL