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Chemistry

Mol. Mass

415.97

ALogP

4.57

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CC1(C)Oc2cc(Cl)ccc2[C@@H]2OCC3(CCN(CCn4ccnc4)CC3)C[C@H]21
  • InChIKey: QKAZUVQTHFXMLS-CTNGQTDRSA-N
    InChI=1S/C23H30ClN3O2/c1-22(2)19-14-23(5-8-26(9-6-23)11-12-27-10-7-25-16-27)15-28-21(19)18-4-3-17(24)13-20(18)29-22/h3-4,7,10,13,16,19,21H,5-6,8-9,11-12,14-15H2,1-2H3/t19-,21+/m1/s1
  • Chirality: None
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL5314914   ChEMBL
dsp-0390

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