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Small molecule Experimental

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Chemistry

Mol. Mass

399.43

ALogP

4.24

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: Cc1cccc(-c2[nH]c(CNc3ccccc3F)nc2-c2ccc3ncnn3c2)n1
  • InChIKey: FJCDSQATIJKQKA-UHFFFAOYSA-N
    InChI=1S/C22H18FN7/c1-14-5-4-8-18(27-14)22-21(15-9-10-20-25-13-26-30(20)12-15)28-19(29-22)11-24-17-7-3-2-6-16(17)23/h2-10,12-13,24H,11H2,1H3,(H,28,29)
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL3260567   ChEMBL
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