Synonyms:
Status: Phase 3
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: M65825806Q

Structure

InChI Key MEEQBDCQPIZMLY-HNNXBMFYSA-N
Smile c1ccc2c(c1)OC[C@H](CNCCCOc1ccc3c(c1)OCO3)O2
InChI
InChI=1S/C19H21NO5/c1-2-5-18-16(4-1)22-12-15(25-18)11-20-8-3-9-21-14-6-7-17-19(10-14)24-13-23-17/h1-2,4-7,10,15,20H,3,8-9,11-13H2/t15-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C19H21NO5
Molecular Weight 343.38
AlogP 2.61
Hydrogen Bond Acceptor 6.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 7.0
Polar Surface Area 58.18
Molecular species BASE
Aromatic Rings 2.0
Heavy Atoms 25.0

Pharmacology

Action Mechanism of Action Reference
AGONIST Serotonin 1a (5-HT1a) receptor agonist PubMed Wikipedia

Related Entries

Scaffolds

Cross References

Resources Reference
ChEMBL CHEMBL1742408
EPA CompTox DTXSID90160127
FDA SRS M65825806Q
PubChem 198747
SureChEMBL SCHEMBL1548269
ZINC ZINC000003799319