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Small molecule Imaging Experimental
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Chemistry

Mol. Mass

454.49

ALogP

5.91

Rule of 5

No

Rule of 3

No
Details
  • SMILES: COc1cccc([C@H]2C[C@@H](N[C@H](C)c3ccccc3)C(=O)N2c2ccc(C(F)(F)F)cc2)c1
  • InChIKey: BPTDWRQYMMIHHK-UOKFIYJESA-N
    InChI=1S/C26H25F3N2O2/c1-17(18-7-4-3-5-8-18)30-23-16-24(19-9-6-10-22(15-19)33-2)31(25(23)32)21-13-11-20(12-14-21)26(27,28)29/h3-15,17,23-24,30H,16H2,1-2H3/t17-,23-,24-/m1/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL493873   ChEMBL
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