APOMORPHINE


SMILES CN1CCC2=CC=CC3=C2C1CC4=C3C(=C(C=C4)O)O
InChIKey VMWNQDUVQKEIOC-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 0
Molecular weight (Da) 267.1

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
D2 DRD2 Human Dopamine A pKi 6.41 7.34 9.21 PDSP Ki database
D3 DRD3 Human Dopamine A pKi 7.14 7.65 8.66 PDSP Ki database
D2 DRD2 Rat Dopamine A pKi 6.27 7.22 7.82 PDSP Ki database
D1 DRD1 Rat Dopamine A pKi 6.0 6.53 7.06 PDSP Ki database
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 6.34 6.63 6.92 PDSP Ki database
5-HT2A 5HT2A Rat 5-Hydroxytryptamine A pKi 5.36 5.61 5.78 PDSP Ki database
D1 DRD1 Human Dopamine A pKi 6.17 6.54 7.14 PDSP Ki database
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 5.31 6.12 6.93 PDSP Ki database
5-HT2C 5HT2C Rat 5-Hydroxytryptamine A pKi 5.96 5.96 5.96 PDSP Ki database
D1 DRD1 Bovine Dopamine A pKi 5.96 7.92 9.34 PDSP Ki database
D4 DRD4 Human Dopamine A pKi 7.35 7.79 8.36 PDSP Ki database
D5 DRD5 Human Dopamine A pKi 6.44 7.13 7.83 PDSP Ki database
D2 DRD2 Bovine Dopamine A pKi 7.29 7.35 7.4 PDSP Ki database
α1B ADA1B Human Adrenoceptors A pKi 6.17 6.17 6.17 PDSP Ki database
α1D ADA1D Human Adrenoceptors A pKi 5.7 6.45 7.19 PDSP Ki database
5-HT1B 5HT1B Human 5-Hydroxytryptamine A pKi 5.53 5.53 5.53 PDSP Ki database
5-HT1D 5HT1D Human 5-Hydroxytryptamine A pKi 5.91 5.91 5.91 PDSP Ki database
α2A ADA2A Human Adrenoceptors A pKi 6.85 6.85 6.85 PDSP Ki database
α2C ADA2C Human Adrenoceptors A pKi 7.44 7.44 7.44 PDSP Ki database
β1 ADRB1 Human Adrenoceptors A pKi 5.0 5.0 5.0 PDSP Ki database
β2 ADRB2 Human Adrenoceptors A pKi 5.0 5.0 5.0 PDSP Ki database
5-HT2B 5HT2B Human 5-Hydroxytryptamine A pKi 6.88 6.88 6.88 PDSP Ki database
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pKi 6.99 6.99 6.99 PDSP Ki database
H1 HRH1 Guinea pig Histamine A pKi 5.0 5.0 5.0 PDSP Ki database
D2 DRD2 Dog Dopamine A pKi 8.7 8.7 8.7 PDSP Ki database
α2B ADA2B Human Adrenoceptors A pKi 7.18 7.18 7.18 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database