bi 1810631 Report issue

Small molecule Experimental

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Chemistry

Mol. Mass

535.61

ALogP

4.42

Rule of 5

No

Rule of 3

No
Details
  • SMILES: C=CC(=O)NC1CCN(c2ncc3ncnc(Nc4ccc(Oc5ccc6c(c5)ncn6C)c(C)c4)c3n2)CC1
  • InChIKey: YSGNGFPNTLERCR-UHFFFAOYSA-N
    InChI=1S/C29H29N9O2/c1-4-26(39)34-19-9-11-38(12-10-19)29-30-15-23-27(36-29)28(32-16-31-23)35-20-5-8-25(18(2)13-20)40-21-6-7-24-22(14-21)33-17-37(24)3/h4-8,13-17,19H,1,9-12H2,2-3H3,(H,34,39)(H,31,32,35)
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL5314498   ChEMBL
zongertinib

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