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Small molecule Experimental

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Chemistry

Mol. Mass

444.58

ALogP

4.28

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: Cc1c(-c2[nH]c3ccc(C4CCN(CC(N)=O)CC4)cc3c2C(C)C)cn2ncnc2c1C
  • InChIKey: SNFVHLQYHFQOEP-UHFFFAOYSA-N
    InChI=1S/C26H32N6O/c1-15(2)24-20-11-19(18-7-9-31(10-8-18)13-23(27)33)5-6-22(20)30-25(24)21-12-32-26(28-14-29-32)17(4)16(21)3/h5-6,11-12,14-15,18,30H,7-10,13H2,1-4H3,(H2,27,33)
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL4650329   ChEMBL
afimetoran

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