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Small molecule Experimental
AACT ChEMBL PubChem

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Chemistry

Mol. Mass

414.9

ALogP

4.6

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CONC(=O)c1ccccc1Nc1cc(Nc2cc(C)nn2C(C)C)ncc1Cl
  • InChIKey: BVAHPPKGOOJSPU-UHFFFAOYSA-N
    InChI=1S/C20H23ClN6O2/c1-12(2)27-19(9-13(3)25-27)24-18-10-17(15(21)11-22-18)23-16-8-6-5-7-14(16)20(28)26-29-4/h5-12H,1-4H3,(H,26,28)(H2,22,23,24)
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL3544967   ChEMBL
gsk-2256098

CHEMBL4742157   ChEMBL
gsk-2256098

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