NLX-101
SMILES | Cc1cnc(nc1)CNCC1(F)CCN(CC1)C(=O)c1ccc(c(c1)Cl)F |
InChIKey | WAAXKNFGOFTGLP-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 5 |
Molecular weight (Da) | 394.1 |
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 |
β3 | ADRB3 | Rhesus macaque | Adrenoceptors | A | pEC50 | 8.15 | 8.7 | 9.24 | ChEMBL |
β3 | ADRB3 | Human | Adrenoceptors | A | pEC50 | 8.8 | 8.88 | 8.96 | ChEMBL |
β3 | ADRB3 | Human | Adrenoceptors | A | pEC50 | 8.05 | 8.05 | 8.05 | Drug Central |
β3 | ADRB3 | Human | Adrenoceptors | A | pEC50 | 8.96 | 8.96 | 8.96 | Guide to Pharmacology |
β3 | ADRB3 | Rhesus macaque | Adrenoceptors | A | pEC50 | 8.03 | 8.03 | 8.03 | Drug Central |
β3 | ADRB3 | Dog | Adrenoceptors | A | pEC50 | 8.1 | 8.1 | 8.1 | Drug Central |
β3 | ADRB3 | Dog | Adrenoceptors | A | pEC50 | 7.96 | 7.96 | 7.96 | ChEMBL |
β3 | ADRB3 | Rat | Adrenoceptors | A | pEC50 | 8.15 | 8.15 | 8.15 | Drug Central |
β3 | ADRB3 | Rat | Adrenoceptors | A | pEC50 | 6.91 | 6.99 | 7.07 | ChEMBL |
β3 | ADRB3 | Rat | Adrenoceptors | A | pEC50 | 7.07 | 7.07 | 7.07 | Guide to Pharmacology |