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Small molecule Imaging Experimental
AACT PubChem

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Chemistry

Mol. Mass

327.36

ALogP

3.05

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CNc1ccc(-c2ccc3cc(OC[C@H](O)CF)ccc3n2)cn1
  • InChIKey: DLVXFZWSPCOWSN-CQSZACIVSA-N
    InChI=1S/C18H18FN3O2/c1-20-18-7-3-13(10-21-18)17-5-2-12-8-15(4-6-16(12)22-17)24-11-14(23)9-19/h2-8,10,14,23H,9,11H2,1H3,(H,20,21)/t14-/m1/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL4650352   ChEMBL
thk-5351

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