phenylacetylrinvanil
SMILES | CCCCCC[C@@H](OC(=O)Cc1ccccc1)C/C=C/CCCCCCCC(=O)NCc1ccc(c(c1)OC)O |
InChIKey | LXLBUUJANYSIKU-SSBKBLCMSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 2 |
Rotatable bonds | 21 |
Molecular weight (Da) | 551.4 |
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 |
M1 | ACM1 | Human | Acetylcholine (muscarinic) | A | pIC50 | 4.11 | 6.73 | 8.52 | ChEMBL |
M1 | ACM1 | Rat | Acetylcholine (muscarinic) | A | pIC50 | 8.3 | 8.52 | 8.85 | ChEMBL |