CHEMBL1360426
SMILES | COc1ccc(-c2nnc3sc(C(C)N4C(=O)c5ccccc5C4=O)nn23)cc1 |
InChIKey | ABAGTJARVQFMJH-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 8 |
Hydrogen bond donors | 0 |
Rotatable bonds | 4 |
Molecular weight (Da) | 405.1 |
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 |
Y2 | NPY2R | Human | Neuropeptide Y | A | pIC50 | 5.22 | 5.22 | 5.22 | ChEMBL |
NPS | NPSR1 | Human | Neuropeptide S | A | Potency | 4.7 | 4.7 | 4.7 | ChEMBL |
Y1 | NPY1R | Human | Neuropeptide Y | A | pIC50 | 5.03 | 5.03 | 5.03 | ChEMBL |