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Small molecule Experimental
AACT ChEMBL PubChem

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Chemistry

Mol. Mass

506.3

ALogP

3.98

Rule of 5

No

Rule of 3

No
Details
  • SMILES: C[C@@H](NC(=O)c1ncnc(N)c1Cl)c2ncc(s2)C(=O)Nc3cc(c(Cl)cn3)C(F)(F)F
  • InChIKey: VWMJHAFYPMOMGF-ZCFIWIBFSA-N
    InChI=1S/C17H12Cl2F3N7O2S/c1-6(28-15(31)12-11(19)13(23)27-5-26-12)16-25-4-9(32-16)14(30)29-10-2-7(17(20,21)22)8(18)3-24-10/h2-6H,1H3,(H,28,31)(H2,23,26,27)(H,24,29,30)/t6-/m1/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL3348923   ChEMBL
mln-2480

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