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Small molecule Experimental

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Chemistry

Mol. Mass

419.98

ALogP

4.86

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CCC(CC)c1cc(C)nc2c(-c3nc(N4CCOCC4)sc3Cl)c(C)nn12
  • InChIKey: CLKXPWDYEYIPFS-UHFFFAOYSA-N
    InChI=1S/C20H26ClN5OS/c1-5-14(6-2)15-11-12(3)22-19-16(13(4)24-26(15)19)17-18(21)28-20(23-17)25-7-9-27-10-8-25/h11,14H,5-10H2,1-4H3
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL5095198   ChEMBL
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