COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL005693
Chemical Name: (3E)-5-bromo-3-{3-[2-(4-methoxyphenyl)ethyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}-1,3-dihydro-2H-indol-2-one
Smiles: COc1ccc(cc1)CCN1C(=S)S/C(=C\2/C(=O)Nc3c2cc(Br)cc3)/C1=O

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Molecular Weight: 475.39
Empirical Formula: C20H15BrN2O3S2

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 3.034
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 116
Number of rings: 4

     

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