rongliflozin Report issue

Small molecule Experimental

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Chemistry

Mol. Mass

450.92

ALogP

1.74

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CCOc1ccc(Cc2cc([C@]34OC[C@]([C@@H](C)O)(O3)[C@@H](O)[C@H](O)[C@H]4O)ccc2Cl)cc1
  • InChIKey: KODGTDKHPNYCCJ-YWRILDCISA-N
    InChI=1S/C23H27ClO7/c1-3-29-17-7-4-14(5-8-17)10-15-11-16(6-9-18(15)24)23-21(28)19(26)20(27)22(31-23,12-30-23)13(2)25/h4-9,11,13,19-21,25-28H,3,10,12H2,1-2H3/t13-,19+,20+,21-,22-,23+/m1/s1
  • Chirality: None
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL5314927   ChEMBL
rongliflozin

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