terbogrel Report issue

Small molecule Experimental
AACT ChEMBL DrugBank MeSH PubChem

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Chemistry

Mol. Mass

405.5

ALogP

4.41

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CC(C)(C)\N=C(/NC#N)\Nc1cccc(c1)\C(=C/CCCC(=O)O)\c2cccnc2
  • InChIKey: XUTLOCQNGLJNSA-RGVLZGJSSA-N
    InChI=1S/C23H27N5O2/c1-23(2,3)28-22(26-16-24)27-19-10-6-8-17(14-19)20(11-4-5-12-21(29)30)18-9-7-13-25-15-18/h6-11,13-15H,4-5,12H2,1-3H3,(H,29,30)(H2,26,27,28)/b20-11+
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL281398   ChEMBL
terbogrel

Terbogrel   Wikipedia

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