Gusacitinib Report issue

Biological Experimental
AACT

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Chemistry

Mol. Mass

460.54

ALogP

2.55

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: N#CCC1CCN(c2nc(Nc3ccc(N4CCC(O)CC4)cc3)c3c(=O)[nH]ncc3n2)CC1
  • InChIKey: NLFLXLJXEIUQDL-UHFFFAOYSA-N
    InChI=1S/C24H28N8O2/c25-10-5-16-6-11-32(12-7-16)24-28-20-15-26-30-23(34)21(20)22(29-24)27-17-1-3-18(4-2-17)31-13-8-19(33)9-14-31/h1-4,15-16,19,33H,5-9,11-14H2,(H,30,34)(H,27,28,29)
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL4594275   ChEMBL
gusacitinib

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