COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK786458
Chemical Name: 3,5-dimethyl-4-[(2S,3S,4R)-3-nitro-2-(trichloromethyl)-3,4-dihydro-2H-chromen-4-yl]-1H-pyrazole
Smiles: [O-][N+](=O)[C@H]1[C@@H](c2ccccc2O[C@@H]1C(Cl)(Cl)Cl)c1c(C)[nH]nc1C

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Molecular Weight: 390.65
Empirical Formula: C15H14Cl3N3O3

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 4.428
Rotatable bonds: 0
H-donors: 1
H-acceptors: 3
PSA: 83
Number of rings: 3

     

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