COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK311304
Chemical Name: [5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]{1-[(3-nitrophenyl)sulfonyl]piperidin-4-yl}methanone
Smiles: O=C(N1N=CCC1(O)C(F)(F)F)C1CCN(CC1)S(=O)(=O)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 450.4
Empirical Formula: C16H17F3N4O6S

Physical State: Dry powder
Available Amount: 51 mg

Lipinsky:
logP: 1.555
Rotatable bonds: 3
H-donors: 1
H-acceptors: 6
PSA: 144
Number of rings: 3

     

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