COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK061582
Chemical Name: 2-[(4E)-4-[2-(2-chlorophenyl)hydrazinylidene]-3-(4-nitrophenyl)-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]-5,5-dimethyl-5,6-dihydro-1,3-benzothiazol-7(4H)-one
Smiles: O=C1N(N=C(/C/1=N\Nc1ccccc1Cl)c1ccc(cc1)[N+](=O)[O-])c1nc2c(s1)C(=O)CC(C2)(C)C

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Molecular Weight: 522.97
Empirical Formula: C24H19ClN6O4S

Physical State: Dry powder
Available Amount: 192 mg

Lipinsky:
logP: 5.491
Rotatable bonds: 0
H-donors: 1
H-acceptors: 4
PSA: 161
Number of rings: 5

     

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