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Small molecule Experimental
AACT PubChem

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Chemistry

Mol. Mass

410.81

ALogP

3.41

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: O=C(Nc1cnccc1Cl)N1CCN(Cc2ccc3c(c2)OC(F)(F)O3)CC1
  • InChIKey: YWGYNGCRVZLMCS-UHFFFAOYSA-N
    InChI=1S/C18H17ClF2N4O3/c19-13-3-4-22-10-14(13)23-17(26)25-7-5-24(6-8-25)11-12-1-2-15-16(9-12)28-18(20,21)27-15/h1-4,9-10H,5-8,11H2,(H,23,26)
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL4297294   ChEMBL
jnj-42165279

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