cirazoline


SMILES C1CN=C(N1)COc1ccccc1C1CC1
InChIKey YAORIDZYZDUZCM-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 216.1

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug Yes

Database connections

Ligand site mutations α1A α1B

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
α1A ADA1A Human Adrenoceptors A pKi 6.2 6.45 6.7 Guide to Pharmacology
α1B ADA1B Human Adrenoceptors A pKi 5.1 5.1 5.1 Guide to Pharmacology
α1D ADA1D Human Adrenoceptors A pKi 5.5 5.5 5.5 Guide to Pharmacology
α1D G3V8W0 Rat Adrenoceptors A pKi 6.9 6.9 6.9 Guide to Pharmacology
α2A ADA2A Human Adrenoceptors A pKi 7.23 7.23 7.23 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 7.46 7.46 7.46 ChEMBL
H3 HRH3 Human Histamine A pKi 5.0 5.0 5.0 PDSP Ki database
α2B ADA2B Human Adrenoceptors A pKi 6.28 6.28 6.28 ChEMBL
α2C ADA2C Human Adrenoceptors A pKi 6.26 6.26 6.26 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
α1A ADA1A Human Adrenoceptors A pEC50 6.9 8.05 9.2 Guide to Pharmacology
α1B ADA1B Human Adrenoceptors A pEC50 6.9 7.5 8.1 Guide to Pharmacology
α1D ADA1D Human Adrenoceptors A pEC50 5.4 6.15 6.9 Guide to Pharmacology
M1 ACM1 Rat Acetylcholine (muscarinic) A Potency 4.8 4.9 5.0 ChEMBL
α1D ADA1D Human Adrenoceptors A pEC50 6.9 6.9 6.9 ChEMBL
α1A ADA1A Human Adrenoceptors A pEC50 7.9 7.9 7.9 ChEMBL
α1B ADA1B Human Adrenoceptors A pEC50 7.2 7.2 7.2 ChEMBL
α2B ADA2B Human Adrenoceptors A pEC50 6.0 6.0 6.0 ChEMBL
α2C ADA2C Human Adrenoceptors A pEC50 6.4 6.4 6.4 ChEMBL
TSH TSHR Human Glycoprotein hormone A Potency 4.4 4.4 4.4 ChEMBL