icapamespib Report issue

Small molecule Experimental

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Chemistry

Mol. Mass

526.4

ALogP

3.53

Rule of 5

No

Rule of 3

No
Details
  • SMILES: CC(C)(C)CNCCn1c(Sc2cc3c(cc2I)OCO3)nc2c(N)ncnc21
  • InChIKey: UYODNJZBUUEXPC-UHFFFAOYSA-N
    InChI=1S/C19H23IN6O2S/c1-19(2,3)8-22-4-5-26-17-15(16(21)23-9-24-17)25-18(26)29-14-7-13-12(6-11(14)20)27-10-28-13/h6-7,9,22H,4-5,8,10H2,1-3H3,(H2,21,23,24)
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL4650317   ChEMBL
icapamespib

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