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Small molecule Experimental
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Chemistry

Mol. Mass

440.47

ALogP

5.04

Rule of 5

No

Rule of 3

No
Details
  • SMILES: C[C@@H]1C[C@H](N)C[C@H](c2ccncc2NC(=O)c2ccc(F)c(-c3c(F)cccc3F)n2)C1
  • InChIKey: VRQXRVAKPDCRCI-ZNMIVQPWSA-N
    InChI=1S/C24H23F3N4O/c1-13-9-14(11-15(28)10-13)16-7-8-29-12-21(16)31-24(32)20-6-5-19(27)23(30-20)22-17(25)3-2-4-18(22)26/h2-8,12-15H,9-11,28H2,1H3,(H,31,32)/t13-,14+,15-/m0/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL3545194   ChEMBL
lgh-447

CHEMBL3651966   ChEMBL
lgh-447

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