Benzatropine

Chemical Properties

SMILES CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(c1ccccc1)c1ccccc1
Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 4
Molecular weight 307.2

Drug Properties

Type Small molecule
Endogenous No
Approved Yes
InChIKey GIJXKZJWITVLHI-PMOLBWCYSA-N

Database Connections

External Links
Ligand site mutations M1


Bioactivity

Receptor Experimental Data Source
GTP Uniprot Species Family Class Type Min Avg Max Database
M1 ACM1 Rat Acetylcholine (muscarinic) A pKi 9.02 9.02 9.02 Guide to Pharmacology
M2 ACM2 Rat Acetylcholine (muscarinic) A pKi 8.59 8.59 8.59 Guide to Pharmacology
M2 ACM2 Rat Acetylcholine (muscarinic) A pKi 8.59 8.59 8.59 ChEMBL
α1B ADA1B Rat Adrenoceptors A pIC50 7.13 7.13 7.13 ChEMBL
α1B ADA1B Rat Adrenoceptors A pKi 7.39 7.39 7.39 ChEMBL
α2B ADA2B Human Adrenoceptors A pIC50 7.19 7.19 7.19 ChEMBL
α2B ADA2B Human Adrenoceptors A pKi 7.52 7.52 7.52 ChEMBL
α1A ADA1A Rat Adrenoceptors A pIC50 6.85 6.85 6.85 ChEMBL
α1A ADA1A Rat Adrenoceptors A pKi 7.24 7.24 7.24 ChEMBL
M1 ACM1 Rat Acetylcholine (muscarinic) A pKi 9.02 9.16 9.23 ChEMBL
M1 ACM1 Rat Acetylcholine (muscarinic) A Potency 8.05 8.3 8.55 ChEMBL
α2C ADA2C Human Adrenoceptors A pIC50 6.4 6.4 6.4 ChEMBL
α2C ADA2C Human Adrenoceptors A pKi 7.24 7.24 7.24 ChEMBL
H2 HRH2 Human Histamine A pIC50 5.92 5.92 5.92 ChEMBL
H2 HRH2 Human Histamine A pKi 5.93 5.93 5.93 ChEMBL
α2A ADA2A Human Adrenoceptors A pIC50 6.26 6.26 6.26 ChEMBL
α2A ADA2A Human Adrenoceptors A pKi 6.69 6.69 6.69 ChEMBL
α1D ADA1D Human Adrenoceptors A pIC50 7.28 7.28 7.28 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 7.58 7.58 7.58 ChEMBL
M5 ACM5 Human Acetylcholine (muscarinic) A pIC50 8.7 8.7 8.7 ChEMBL
M5 ACM5 Human Acetylcholine (muscarinic) A pKi 8.84 8.84 8.84 ChEMBL
H1 HRH1 Human Histamine A pIC50 8.5 8.5 8.5 ChEMBL
H1 HRH1 Human Histamine A pKi 9.43 9.43 9.43 ChEMBL
M4 ACM4 Human Acetylcholine (muscarinic) A pIC50 8.3 8.46 8.62 ChEMBL
M4 ACM4 Human Acetylcholine (muscarinic) A pKi 9.48 9.48 9.48 ChEMBL
M3 ACM3 Human Acetylcholine (muscarinic) A pIC50 7.7 8.29 8.89 ChEMBL
M3 ACM3 Human Acetylcholine (muscarinic) A pKi 9.56 9.56 9.56 ChEMBL
5-HT2B 5HT2B Human 5-Hydroxytryptamine A pIC50 6.7 6.7 6.7 ChEMBL
5-HT2B 5HT2B Human 5-Hydroxytryptamine A pKi 6.9 6.9 6.9 ChEMBL
M2 ACM2 Human Acetylcholine (muscarinic) A pIC50 7.2 7.6 8.0 ChEMBL
M2 ACM2 Human Acetylcholine (muscarinic) A pKi 8.44 8.44 8.44 ChEMBL
5-HT6 5HT6R Human 5-Hydroxytryptamine A pIC50 5.55 5.55 5.55 ChEMBL
5-HT6 5HT6R Human 5-Hydroxytryptamine A pKi 5.89 5.89 5.89 ChEMBL
M1 ACM1 Human Acetylcholine (muscarinic) A pIC50 9.26 9.26 9.26 ChEMBL
M1 ACM1 Human Acetylcholine (muscarinic) A pKi 9.88 9.88 9.88 ChEMBL
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pIC50 7.21 7.21 7.21 ChEMBL
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pKi 7.5 7.5 7.5 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pIC50 7.62 7.62 7.62 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 8.16 8.16 8.16 ChEMBL
D3 DRD3 Human Dopamine A pIC50 6.18 6.18 6.18 ChEMBL
D3 DRD3 Human Dopamine A pKi 6.65 6.65 6.65 ChEMBL
TSH TSHR Human Glycoprotein hormone A Potency 4.7 4.7 4.7 ChEMBL