COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK018306
Chemical Name: 4-[(2Z)-2-{3-methyl-1-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene}hydrazinyl]benzoicacid
Smiles: CC1=NN(C(=O)/C/1=N\Nc1ccc(cc1)C(=O)O)c1scc(n1)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 450.43
Empirical Formula: C20H14N6O5S

Physical State: Dry powder
Available Amount: 220 mg

Lipinsky:
logP: 2.395
Rotatable bonds: 2
H-donors: 2
H-acceptors: 5
PSA: 181
Number of rings: 4

     

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