ensifentrine Report issue

Small molecule Experimental

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Chemistry

Mol. Mass

477.57

ALogP

2.72

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: COc1cc2c(cc1OC)-c1c/c(=N\c3c(C)cc(C)cc3C)n(CCNC(N)=O)c(=O)n1CC2
  • InChIKey: CSOBIBXVIYAXFM-BYNJWEBRSA-N
    InChI=1S/C26H31N5O4/c1-15-10-16(2)24(17(3)11-15)29-23-14-20-19-13-22(35-5)21(34-4)12-18(19)6-8-30(20)26(33)31(23)9-7-28-25(27)32/h10-14H,6-9H2,1-5H3,(H3,27,28,32)/b29-23+
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL4594287   ChEMBL
ensifentrine

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