COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK861791
Chemical Name: (3Z)-5-bromo-3-{3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}-1,3-dihydro-2H-indol-2-one
Smiles: COc1cc(CCN2C(=S)S/C(=C/3\C(=O)Nc4c3cc(Br)cc4)/C2=O)ccc1OC

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Molecular Weight: 505.41
Empirical Formula: C21H17BrN2O4S2

Physical State: Dry powder
Available Amount: 405 mg

Lipinsky:
logP: 2.856
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 125
Number of rings: 4

     

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