abivertinib Report issue

Small molecule Experimental

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Chemistry

Mol. Mass

487.54

ALogP

4.51

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: C=CC(=O)Nc1cccc(Oc2nc(Nc3ccc(N4CCN(C)CC4)c(F)c3)nc3[nH]ccc23)c1
  • InChIKey: UOFYSRZSLXWIQB-UHFFFAOYSA-N
    InChI=1S/C26H26FN7O2/c1-3-23(35)29-17-5-4-6-19(15-17)36-25-20-9-10-28-24(20)31-26(32-25)30-18-7-8-22(21(27)16-18)34-13-11-33(2)12-14-34/h3-10,15-16H,1,11-14H2,2H3,(H,29,35)(H2,28,30,31,32)
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL4297865   ChEMBL
abivertinib

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