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HIT218695469
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HIT218695469
  • HIT ID:HIT218695469
  • Cas No:192658-64-3
  • Common Name:Tasidotin
  • alias:05G07285DK
  • IUPAC:(2S)-N-tert-butyl-1-[(2S)-1-[(2S)-2-[(2S)-2-[(2S)-2-(dimethylamino)-3-methylbutanamido]-N,3-dimethylbutanamido]-3-methylbutanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide
    IUPAC:(2S)-N-tert-butyl-1-[(2S)-1-[(2S)-2-[(2S)-2-[(2S)-2-(dimethylamino)-3-methylbutanamido]-N,3-dimethylbutanamido]-3-methylbutanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide
  • InChI key:QMCOCIWNMHBIIA-LROMGURASA-N
  • Molecular Formula:C32H58N6O5
  • Molecular Weight:606.853
  • Hydrogen Bond Donor (HBD):
  • Hydrogen Bond Acceptor (HBA):
  • LogP:
  • SMILES:CC(C)[C@H](NC(=O)[C@H](C(C)C)N(C)C)C(=O)N(C)[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)NC(C)(C)C
    SMILES:CC(C)[C@H](NC(=O)[C@H](C(C)C)N(C)C)C(=O)N(C)[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)NC(C)(C)C
  • Tasidotin (also known as ILX-651) is an orally active synthetic derivative targeting microtubules, derived from the marine depsipeptide dolastatin-15.
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    TargetMolSC
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