COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK625323
Chemical Name: 4-[(5E)-5-{[2-(methoxycarbonyl)-1H-indol-3-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzoicacid
Smiles: COC(=O)c1[nH]c2c(c1/C=C\1/SC(=S)N(C1=O)c1ccc(cc1)C(=O)O)cccc2

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Molecular Weight: 438.48
Empirical Formula: C21H14N2O5S2

Physical State: Dry powder
Available Amount: 243 mg

Lipinsky:
logP: 4.485
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 157
Number of rings: 4

     

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