Details of the Drug

General Information of Drug (ID: DMX1UHG)

Drug Name
Simenepag isopropyl
Synonyms Simenepag; AGN-210669; AGN-210699
Indication
Disease Entry ICD 11 Status REF
Ocular hypertension 9C61.01 Phase 2 [1]
Drug Type
Small molecular drug
Structure
3D MOL 2D MOL
Chemical Identifiers
Formula
C26H35NO5S
Canonical SMILES
CCCCCC(C1=CC=C(C=C1)N2C(CCC2=O)COCC3=CC=C(S3)C(=O)OC(C)C)O
InChI
InChI=1S/C26H35NO5S/c1-4-5-6-7-23(28)19-8-10-20(11-9-19)27-21(12-15-25(27)29)16-31-17-22-13-14-24(33-22)26(30)32-18(2)3/h8-11,13-14,18,21,23,28H,4-7,12,15-17H2,1-3H3/t21-,23+/m1/s1
InChIKey
MSIIJNOQQWRTFC-GGAORHGYSA-N
Cross-matching ID
PubChem CID
46902081
CAS Number
910562-13-9
UNII
8908HU0G4K
DrugBank ID
DB12977
TTD ID
D00EVP
Drug ADMET Endpoint Profile (DAE)NEW Click to Jump to the Detailed DAE Information of This Drug

References

1 Macrogol 15 hydroxystearate formulations US 20130005665 A1.