fedratinib (Inrebic) Report issue

Small molecule Orphan Drug FDA Approved FDA Priority Review FDA
AACT ChEMBL DrugBank MeSH PubChem

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Chemistry

Mol. Mass

524.678

ALogP

4.82

Rule of 5

No

Rule of 3

No
Details
  • SMILES: CC1=CN=C(NC2=CC=C(OCCN3CCCC3)C=C2)N=C1NC4=CC=CC(=C4)S(=O)(=O)NC(C)(C)C
  • InChIKey: JOOXLOJCABQBSG-UHFFFAOYSA-N
    1S/C27H36N6O3S/c1-20-19-28-26(30-21-10-12-23(13-11-21)36-17-16-33-14-5-6-15-33)31-25(20)29-22-8-7-9-24(18-22)37(34,35)32-27(2,3)4/h7-13,18-19,32H,5-6,14-17H2,1-4H3,(H2,28,29,30,31)
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL1287853   ChEMBL
fedratinib

CHEMBL4297216   ChEMBL
fedratinib hydrochloride

6L1XP550I6   NCATS
fedratinib *

Fedratinib   Wikipedia

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