COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK786462
Chemical Name: (3Z)-4-hydroxy-3-[(2S,3S,4S)-3-nitro-2-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]pent-3-en-2-one
Smiles: C/C(=C(\[C@@H]1c2ccccc2O[C@@H]([C@H]1[N+](=O)[O-])C(F)(F)F)/C(=O)C)/O

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Molecular Weight: 345.28
Empirical Formula: C15H14F3NO5

Physical State: Dry powder
Available Amount: 66 mg

Lipinsky:
logP: 3.903
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 92
Number of rings: 2

     

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