L-365260
SMILES | Cc1cccc(c1)NC(=O)NC1N=C(c2ccccc2)c2c(N(C1=O)C)cccc2 |
InChIKey | KDFQABSFVYLGPM-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 2 |
Rotatable bonds | 3 |
Molecular weight (Da) | 398.2 |
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 |
OX1 | OX1R | Human | Orexin | A | pKi | 8.41 | 8.78 | 8.96 | ChEMBL |
OX1 | OX1R | Human | Orexin | A | pKd | 8.29 | 8.29 | 8.29 | ChEMBL |
OX1 | OX1R | Human | Orexin | A | pKi | 8.7 | 9.0 | 9.3 | Guide to Pharmacology |
OX2 | OX2R | Human | Orexin | A | pKi | 6.89 | 6.89 | 6.89 | ChEMBL |
OX2 | OX2R | Human | Orexin | A | pKi | 6.6850000000000005 | 6.69 | 6.69 | Guide to Pharmacology |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
OX2 | OX2R | Human | Orexin | A | pKB | 6.86 | 6.86 | 6.86 | Guide to Pharmacology |