encorafenib (braftovi) Report issue

Small molecule Orphan Drug FDA Approved FDA
AACT ChEMBL DrugBank Drugs@FDA MeSH PubChem

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Chemistry

Mol. Mass

540.011

ALogP

3.91

Rule of 5

No

Rule of 3

No
Details
  • SMILES: COC(=O)N[C@@H](C)CNC1=NC=CC(=N1)C2=CN(N=C2C3=CC(Cl)=CC(NS(C)(=O)=O)=C3F)C(C)C
  • InChIKey: CMJCXYNUCSMDBY-ZDUSSCGKSA-N
    1S/C22H27ClFN7O4S/c1-12(2)31-11-16(17-6-7-25-21(28-17)26-10-13(3)27-22(32)35-4)20(29-31)15-8-14(23)9-18(19(15)24)30-36(5,33)34/h6-9,11-13,30H,10H2,1-5H3,(H,27,32)(H,25,26,28)/t13-/m0/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL3301612   ChEMBL
encorafenib

8L7891MRB6   NCATS
encorafenib *

Encorafenib   Wikipedia

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