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Small molecule Experimental
AACT PubChem

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Chemistry

Mol. Mass

505.56

ALogP

6.35

Rule of 5

No

Rule of 3

No
Details
  • SMILES: CC(C)CC(=O)Nc1cncc(-c2ccc3[nH]nc(-c4nc5cncc(-c6cccc(F)c6)c5[nH]4)c3c2)c1
  • InChIKey: AQDWDWAYVBQMAM-UHFFFAOYSA-N
    InChI=1S/C29H24FN7O/c1-16(2)8-26(38)33-21-10-19(12-31-13-21)17-6-7-24-22(11-17)28(37-36-24)29-34-25-15-32-14-23(27(25)35-29)18-4-3-5-20(30)9-18/h3-7,9-16H,8H2,1-2H3,(H,33,38)(H,34,35)(H,36,37)
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL4297639   ChEMBL
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