carazolol
SMILES | OC(COc1cccc2c1c1ccccc1[nH]2)CNC(C)C |
InChIKey | BQXQGZPYHWWCEB-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 3 |
Rotatable bonds | 6 |
Molecular weight (Da) | 298.2 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | Yes |
Database connections
Structure pdb | 6PS0 |
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
β1 | ADRB1 | Human | Adrenoceptors | A | pKd | 9.7 | 9.95 | 10.2 | Guide to Pharmacology |
β3 | ADRB3 | Human | Adrenoceptors | A | pKi | 8.4 | 8.4 | 8.4 | Guide to Pharmacology |
β3 | ADRB3 | Mouse | Adrenoceptors | A | pKi | 7.7 | 7.7 | 7.7 | Guide to Pharmacology |
β3 | ADRB3 | Rat | Adrenoceptors | A | pKi | 7.7 | 7.7 | 7.7 | Guide to Pharmacology |
β1 | ADRB1 | Mouse | Adrenoceptors | A | pKi | 10.05 | 10.05 | 10.05 | ChEMBL |
5-HT2C | K7GSR7 | Pig | 5-Hydroxytryptamine | A | pKi | 5.2 | 5.2 | 5.2 | PDSP Ki database |
β2 | ADRB2 | Human | Adrenoceptors | A | pKi | 9.94 | 9.94 | 9.94 | PDSP Ki database |
β3 | ADRB3 | Human | Adrenoceptors | A | pKi | 8.06 | 8.06 | 8.06 | Drug Central |
β3 | ADRB3 | Mouse | Adrenoceptors | A | pKi | 8.11 | 8.11 | 8.11 | Drug Central |
β3 | ADRB3 | Rat | Adrenoceptors | A | pKi | 8.11 | 8.11 | 8.11 | Drug Central |
β2 | ADRB2 | Human | Adrenoceptors | A | pKi | 8.0 | 8.0 | 8.0 | Drug Central |
β2 | ADRB2 | Human | Adrenoceptors | A | pKi | 9.94 | 10.23 | 10.52 | ChEMBL |
β2 | ADRB2 | Human | Adrenoceptors | A | pKi | 9.9 | 10.2 | 10.5 | Guide to Pharmacology |
β1 | ADRB1 | Mouse | Adrenoceptors | A | pKi | 8.0 | 8.0 | 8.0 | Drug Central |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
β3 | ADRB3 | Human | Adrenoceptors | A | pEC50 | 8.8 | 8.8 | 8.8 | Guide to Pharmacology |