Compound Information | SONAR Target prediction |
Name: | ACETYLSEROTONIN |
Unique Identifier: | SPE01500700 |
MolClass: | Checkout models in ver1.5 and ver1.0 |
Molecular Formula: | C12H14N2O2 |
Molecular Weight: | 204.141 g/mol |
X log p: | 8.032 (online calculus) |
Lipinksi Failures | 1 |
TPSA | 17.07 |
Hydrogen Bond Donor Count: | 0 |
Hydrogen Bond Acceptors Count: | 4 |
Rotatable Bond Count: | 4 |
Canonical Smiles: | CC(=O)NCCc1cnc2ccc(O)cc12 |
Source: | metabolite of serotonin |
Reference: | J Biol Chem 234: 858 (1959); J Pharm Sci 57: 1998 (1968) |
Therapeutics: | inhibits hydroxyindole-O-methyltransferase |