CHEMBL154023
SMILES | Cc1ncoc1-c1ccccc1NCC1=NCCN1 |
InChIKey | KUBADPQAWRUMPM-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 2 |
Rotatable bonds | 4 |
Molecular weight (Da) | 256.1 |
Drug properties
Molecular type | Small molecule |
Endogenous/Surrogate | Surrogate |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
α1B | ADA1B | Human | Adrenoceptors | A | pIC50 | 6.49 | 6.49 | 6.49 | ChEMBL |
α1D | ADA1D | Human | Adrenoceptors | A | pIC50 | 6.46 | 6.46 | 6.46 | ChEMBL |
α1A | ADA1A | Human | Adrenoceptors | A | pIC50 | 6.72 | 6.72 | 6.72 | ChEMBL |
α1A | ADA1A | Human | Adrenoceptors | A | pEC50 | 7.82 | 7.82 | 7.82 | ChEMBL |