CHEMBL3656497
SMILES | Cc1cc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)ncn1 |
InChIKey | KACMTGFNFZWARI-AWEZNQCLSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 2 |
Rotatable bonds | 5 |
Molecular weight (Da) | 297.2 |
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 |
TA1 | TAAR1 | Rat | Trace amine | A | pKi | 8.89 | 8.89 | 8.89 | ChEMBL |
TA1 | TAAR1 | Mouse | Trace amine | A | pKi | 7.74 | 7.74 | 7.74 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |