COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK806242
Chemical Name: (3E)-3-[3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]-5-nitro-1,3-dihydro-2H-indol-2-one
Smiles: S=C1S/C(=C\2/C(=O)Nc3c2cc(cc3)[N+](=O)[O-])/C(=O)N1c1c(=O)n(n(c1C)C)c1ccccc1

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Molecular Weight: 493.52
Empirical Formula: C22H15N5O5S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.988
Rotatable bonds: 0
H-donors: 1
H-acceptors: 5
PSA: 176
Number of rings: 5

     

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