SETOGEPRAM

Search structure
Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 879OVM0Y1S

Structure
InChI Key PEGQOIGYZLJMIB-UHFFFAOYSA-N
Smile CCCCCc1cccc(CC(=O)O)c1
InChI
InChI=1S/C13H18O2/c1-2-3-4-6-11-7-5-8-12(9-11)10-13(14)15/h5,7-9H,2-4,6,10H2,1H3,(H,14,15)

Physicochemical Descriptors

Property Name Value
Molecular Formula C13H18O2
Molecular Weight 206.28
AlogP 3.05
Hydrogen Bond Acceptor 1.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 6.0
Polar Surface Area 37.3
Molecular species ACID
Aromatic Rings 1.0
Heavy Atoms 15.0

Cross References

Resources Reference
ChEMBL CHEMBL4297635
DrugBank DB15447
FDA SRS 879OVM0Y1S
Guide to Pharmacology 10043
SureChEMBL SCHEMBL289216
ZINC ZINC000113492390
CONTENTS