COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK821998
Chemical Name: 4-methyl-N-(2,2,2-trichloro-1-{4-[(Z)-{3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}methyl]phenoxy}ethyl)benzamide
Smiles: COc1cc(CCN2C(=S)S/C(=C\c3ccc(cc3)OC(C(Cl)(Cl)Cl)NC(=O)c3ccc(cc3)C)/C2=O)ccc1OC

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Molecular Weight: 666.04
Empirical Formula: C30H27Cl3N2O5S2

Physical State: Dry powder
Available Amount: 103 mg

Lipinsky:
logP: 7.07
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 134
Number of rings: 4

     

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