Exarafenib Report issue

Small molecule Experimental

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Chemistry

Mol. Mass

521.58

ALogP

4.49

Rule of 5

No

Rule of 3

No
Details
  • SMILES: Cc1ccc(NC(=O)N2CC[C@@H](CC(F)(F)F)C2)cc1-c1cc(N[C@H](C)CO)nc(N2CCOCC2)c1
  • InChIKey: GZMYLSJUNSCMTD-MOPGFXCFSA-N
    InChI=1S/C26H34F3N5O3/c1-17-3-4-21(31-25(36)34-6-5-19(15-34)14-26(27,28)29)13-22(17)20-11-23(30-18(2)16-35)32-24(12-20)33-7-9-37-10-8-33/h3-4,11-13,18-19,35H,5-10,14-16H2,1-2H3,(H,30,32)(H,31,36)/t18-,19+/m1/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL5095099   ChEMBL
exarafenib

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