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Small molecule Experimental
AACT ChEMBL PubChem

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Chemistry

Mol. Mass

382.4

ALogP

3.03

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CC(C)Oc1cc(-n2cnc3ccc(N[C@@H](C)c4ncc(F)cn4)nc32)n[nH]1
  • InChIKey: AYOOGWWGECJQPI-NSHDSACASA-N
    InChI=1S/C18H19FN8O/c1-10(2)28-16-6-15(25-26-16)27-9-22-13-4-5-14(24-18(13)27)23-11(3)17-20-7-12(19)8-21-17/h4-11H,1-3H3,(H,23,24)(H,25,26)/t11-/m0/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL3545179   ChEMBL
azd-7451

CHEMBL3659497   ChEMBL
azd-7451

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