COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK046925
Chemical Name: (4E)-2-(4-tert-butyl-1,3-thiazol-2-yl)-4-[2-(2,6-dichloro-4-nitrophenyl)hydrazinylidene]-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: CC1=NN(C(=O)/C/1=N/Nc1c(Cl)cc(cc1Cl)[N+](=O)[O-])c1scc(n1)C(C)(C)C

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Molecular Weight: 455.32
Empirical Formula: C17H16Cl2N6O3S

Physical State: Dry powder
Available Amount: 112 mg

Lipinsky:
logP: 4.362
Rotatable bonds: 0
H-donors: 1
H-acceptors: 3
PSA: 144
Number of rings: 3

     

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