(+)-cyclazosin
SMILES | COc1cc2nc(nc(c2cc1OC)N)N1CCN([C@@H]2[C@H]1CCCC2)C(=O)c1ccco1 |
InChIKey | XBRXTUGRUXGBPX-DLBZAZTESA-N |
Chemical properties
Hydrogen bond acceptors | 8 |
Hydrogen bond donors | 1 |
Rotatable bonds | 4 |
Molecular weight (Da) | 437.2 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Structure pdb | 7B6W |
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
α1A | ADA1A | Human | Adrenoceptors | A | pKi | 7.9 | 8.4 | 8.9 | Guide to Pharmacology |
α1B | ADA1B | Human | Adrenoceptors | A | pKi | 8.7 | 9.3 | 9.9 | Guide to Pharmacology |
α1D | ADA1D | Human | Adrenoceptors | A | pKi | 8.5 | 9.2 | 9.9 | Guide to Pharmacology |
α1B | ADA1B | Rat | Adrenoceptors | A | pKd | 9.16 | 9.17 | 9.18 | ChEMBL |
α1B | ADA1B | Human | Adrenoceptors | A | pKi | 9.16 | 9.6 | 9.87 | ChEMBL |
α1A | ADA1A | Rat | Adrenoceptors | A | pKd | 7.48 | 7.98 | 8.91 | ChEMBL |
α1A | ADA1A | Rat | Adrenoceptors | A | pKi | 8.77 | 8.77 | 8.77 | ChEMBL |
α1D | ADA1D | Human | Adrenoceptors | A | pKi | 7.5 | 8.56 | 9.77 | ChEMBL |
D2 | DRD2 | Rat | Dopamine | A | pKi | 5.08 | 5.08 | 5.08 | ChEMBL |
α1A | ADA1A | Human | Adrenoceptors | A | pKi | 7.6 | 7.92 | 8.26 | ChEMBL |
5-HT1A | 5HT1A | Rat | 5-Hydroxytryptamine | A | pKi | 5.21 | 5.21 | 5.21 | ChEMBL |
α1A | ADA1A | Bovine | Adrenoceptors | A | pKi | 8.62 | 8.62 | 8.62 | ChEMBL |
α1D | G3V8W0 | Rat | Adrenoceptors | A | pKi | 7.6 | 7.6 | 7.6 | Guide to Pharmacology |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |