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Small molecule Experimental

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Chemistry

Mol. Mass

286.33

ALogP

1.75

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CC1(C)Oc2ccc(C#N)cc2[C@@H](N2CCCC2=O)[C@@H]1O
  • InChIKey: TVZCRIROJQEVOT-CABCVRRESA-N
    InChI=1S/C16H18N2O3/c1-16(2)15(20)14(18-7-3-4-13(18)19)11-8-10(9-17)5-6-12(11)21-16/h5-6,8,14-15,20H,3-4,7H2,1-2H3/t14-,15+/m1/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL100   ChEMBL
levcromakalim

Cromakalim   Wikipedia

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