Synonyms
Status
Molecule Category UNKNOWN
ATC A10BX08
UNII D86I0XLB13
EPA CompTox DTXSID4048303

Structure

InChI Key WPGGHFDDFPHPOB-BBWFWOEESA-N
Smiles O=C(O)[C@H](CC(=O)N1C[C@H]2CCCC[C@H]2C1)Cc1ccccc1
InChI
InChI=1S/C19H25NO3/c21-18(20-12-15-8-4-5-9-16(15)13-20)11-17(19(22)23)10-14-6-2-1-3-7-14/h1-3,6-7,15-17H,4-5,8-13H2,(H,22,23)/t15-,16+,17-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C19H25NO3
Molecular Weight 315.41
AlogP 2.97
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 5.0
Polar Surface Area 57.61
Molecular species ACID
Aromatic Rings 1.0
Heavy Atoms 23.0
Assay Description Organism Bioactivity Reference
Increase in insulin releasing activity in Syrian golden hamster HIT-T15 cells after 1 hr Mesocricetus auratus 708.0 nM

Cross References

Resources Reference
ChEBI 135349
ChEMBL CHEMBL471498
DrugBank DB01252
DrugCentral 1818
FDA SRS D86I0XLB13
PubChem 121891
SureChEMBL SCHEMBL49085
ZINC ZINC000001482913