dndi-0690 Report issue

Small molecule Experimental

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Chemistry

Mol. Mass

370.34

ALogP

3.22

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: O=[N+]([O-])c1cn2c(n1)O[C@@H](COc1ccc(-c3ccc(F)cc3)nc1)CC2
  • InChIKey: USIKCXQLXHGVDD-OAHLLOKOSA-N
    InChI=1S/C18H15FN4O4/c19-13-3-1-12(2-4-13)16-6-5-14(9-20-16)26-11-15-7-8-22-10-17(23(24)25)21-18(22)27-15/h1-6,9-10,15H,7-8,11H2/t15-/m1/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL4069220   ChEMBL
dndi-0690

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