(+)-CYCLAZOSIN
SMILES | COc1cc2nc(N3CCN(C(=O)c4ccco4)[C@H]4CCCC[C@@H]43)nc(N)c2cc1OC |
InChIKey | XBRXTUGRUXGBPX-IRXDYDNUSA-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
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
α1B | ADA1B | Rat | Adrenoceptors | A | pKi | 9.68 | 9.68 | 9.68 | ChEMBL |
α1B | ADA1B | Human | Adrenoceptors | A | pKi | 9.16 | 9.52 | 9.87 | ChEMBL |
α1A | ADA1A | Human | Adrenoceptors | A | pKi | 7.91 | 7.91 | 7.91 | ChEMBL |
α1D | ADA1D | Human | Adrenoceptors | A | pKi | 8.49 | 8.49 | 8.49 | ChEMBL |
α1A | ADA1A | Rat | Adrenoceptors | A | pKd | 7.77 | 7.78 | 7.78 | ChEMBL |
α1A | ADA1A | Rat | Adrenoceptors | A | pKi | 7.73 | 7.73 | 7.73 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |