COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK015264
Chemical Name: 4-{(2E)-2-[1-(4-tert-butyl-1,3-thiazol-2-yl)-3-(4-nitrophenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazinyl}benzenesulfonamide
Smiles: O=C1/C(=N/Nc2ccc(cc2)S(=O)(=O)N)/C(=NN1c1scc(n1)C(C)(C)C)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 527.58
Empirical Formula: C22H21N7O5S2

Physical State: Dry powder
Available Amount: 64 mg

Lipinsky:
logP: 2.978
Rotatable bonds: 0
H-donors: 3
H-acceptors: 5
PSA: 212
Number of rings: 4

     

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