COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK822015
Chemical Name: 4-methoxy-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: COc1ccc(cc1)C(=O)NC(C(Cl)(Cl)Cl)Oc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCc1ccc(c(c1)OC)OC

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Molecular Weight: 682.04
Empirical Formula: C30H27Cl3N2O6S2

Physical State: Dry powder
Available Amount: 106 mg

Lipinsky:
logP: 6.776
Rotatable bonds: 7
H-donors: 1
H-acceptors: 6
PSA: 143
Number of rings: 4

     

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