COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK702442
Chemical Name: (3Z)-1-benzyl-5-bromo-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]-1,3-dihydro-2H-indol-2-one
Smiles: Brc1ccc2c(c1)/C(=C\1/SC(=S)N(C1=O)c1c(=O)n(n(c1C)C)c1ccccc1)/C(=O)N2Cc1ccccc1

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Molecular Weight: 617.55
Empirical Formula: C29H21BrN4O3S2

Physical State: Dry powder
Available Amount: 102 mg

Lipinsky:
logP: 3.818
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 121
Number of rings: 6

     

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