General Information of Drug (ID: DMDB6H0)

Drug Name
CELIKALIM
Synonyms WAY-120491; (-)-trans-(3S,4R)-2-[3-Hydroxy-2,2-dimethyl-6-(trifluoromethoxy)-3,4-dihydro-2H-1-benzopyran-4-yl]-2,3-dihydro-1H-isoindol-1-one
Indication
Disease Entry ICD 11 Status REF
Hypertension BA00-BA04 Phase 2 [1]
Drug Type
Small molecular drug
Structure
3D MOL 2D MOL
Chemical Identifiers
Formula
C20H18F3NO4
Canonical SMILES
CC1(C(C(C2=C(O1)C=CC(=C2)OC(F)(F)F)N3CC4=CC=CC=C4C3=O)O)C
InChI
1S/C20H18F3NO4/c1-19(2)17(25)16(24-10-11-5-3-4-6-13(11)18(24)26)14-9-12(27-20(21,22)23)7-8-15(14)28-19/h3-9,16-17,25H,10H2,1-2H3/t16-,17+/m1/s1
InChIKey
ZORATYFUTXFLJS-SJORKVTESA-N
Cross-matching ID
PubChem CID
130292
CAS Number
124916-54-7
TTD ID
D0L5AH

References

1 Trusted, scientifically sound profiles of drug programs, clinical trials, safety reports, and company deals, written by scientists. Springer. 2015. Adis Insight (drug id 800006442 )