Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 358M5150LY

Structure

InChI Key JVCPIJKPAKAIIP-UHFFFAOYSA-N
Smile CCCCCCCOc1ccc(CCC(N)(CO)CO)cc1C(F)(F)F
InChI
InChI=1S/C19H30F3NO3/c1-2-3-4-5-6-11-26-17-8-7-15(12-16(17)19(20,21)22)9-10-18(23,13-24)14-25/h7-8,12,24-25H,2-6,9-11,13-14,23H2,1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C19H30F3NO3
Molecular Weight 377.45
AlogP 3.67
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 12.0
Polar Surface Area 75.71
Molecular species BASE
Aromatic Rings 1.0
Heavy Atoms 26.0

Cross References

Resources Reference
ChEMBL CHEMBL3707375
FDA SRS 358M5150LY
Guide to Pharmacology 9319
PubChem 16129483
SureChEMBL SCHEMBL2463680
ZINC ZINC000043170189