BUTACLAMOL


SMILES CC(C)(C)C1(CCN2CC3C4=CC=CC=C4CCC5=C3C(=CC=C5)C2C1)O
InChIKey ZZJYIKPMDIWRSN-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 0
Molecular weight (Da) 361.2

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 5.52 6.81 8.18 PDSP Ki database
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 9.4 9.4 9.4 PDSP Ki database
5-HT2A 5HT2A Rat 5-Hydroxytryptamine A pKi 5.0 5.54 5.88 PDSP Ki database
5-HT2B F6QI78 Bovine 5-Hydroxytryptamine A pKi 5.0 5.0 5.0 PDSP Ki database
5-HT7 5HT7R Rat 5-Hydroxytryptamine A pKi 7.05 7.05 7.05 PDSP Ki database
α2C ADA2C Human Adrenoceptors A pKi 7.38 7.38 7.38 PDSP Ki database
α2B ADA2B Rat Adrenoceptors A pKi 7.92 7.92 7.92 PDSP Ki database
5-HT7 5HT7R Guinea pig 5-Hydroxytryptamine A pKi 6.06 6.39 6.72 PDSP Ki database
5-HT6 5HT6R Mouse 5-Hydroxytryptamine A pKi 5.0 5.0 5.0 PDSP Ki database
D2 DRD2 Human Dopamine A pKi 5.0 7.59 9.8 PDSP Ki database
D3 DRD3 Human Dopamine A pKi 6.0 7.86 8.8 PDSP Ki database
H1 HRH1 Human Histamine A pKi 6.41 6.41 6.41 PDSP Ki database
D2 DRD2 Bovine Dopamine A pKi 5.0 5.58 6.15 PDSP Ki database
D2 DRD2 Rat Dopamine A pKi 5.0 5.89 8.51 PDSP Ki database
D1 DRD1 Bovine Dopamine A pKi 5.0 5.25 5.49 PDSP Ki database
5-HT1F 5HT1F Human 5-Hydroxytryptamine A pKi 5.41 5.41 5.41 PDSP Ki database
D4 DRD4 Human Dopamine A pKi 6.22 6.5 6.79 PDSP Ki database
D2 DRD2 Mouse Dopamine A pKi 5.0 5.0 5.0 PDSP Ki database
D1 DRD1 Mouse Dopamine A pKi 5.0 5.0 5.0 PDSP Ki database
D1 DRD1 Rat Dopamine A pKi 5.05 5.05 5.05 PDSP Ki database
D1 DRD1 Rhesus macaque Dopamine A pKi 5.0 5.0 5.0 PDSP Ki database
α2A ADA2A Human Adrenoceptors A pKi 7.28 7.28 7.28 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database