emraclidine Report issue

Small molecule Experimental

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Chemistry

Mol. Mass

390.41

ALogP

3.48

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: Cc1cc(C)c2c(n1)CN(C(=O)CC1CN(c3ccnc(C(F)(F)F)c3)C1)C2
  • InChIKey: DTCZNKWBDTXEBS-UHFFFAOYSA-N
    InChI=1S/C20H21F3N4O/c1-12-5-13(2)25-17-11-27(10-16(12)17)19(28)6-14-8-26(9-14)15-3-4-24-18(7-15)20(21,22)23/h3-5,7,14H,6,8-11H2,1-2H3
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL5314557   ChEMBL
emraclidine

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