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Chemistry

Mol. Mass

477.57

ALogP

4.73

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CC(C)Cn1c2ccc(Nc3ncccn3)cc2c4c5CNC(=O)c5c6c(CCc7nn(C)cc67)c14
  • InChIKey: AEULIVPVIDOLIN-UHFFFAOYSA-N
    InChI=1S/C28H27N7O/c1-15(2)13-35-22-8-5-16(32-28-29-9-4-10-30-28)11-18(22)24-19-12-31-27(36)25(19)23-17(26(24)35)6-7-21-20(23)14-34(3)33-21/h4-5,8-11,14-15H,6-7,12-13H2,1-3H3,(H,31,36)(H,29,30,32)
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL2010872   ChEMBL
cep-11981

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