COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK396580
Chemical Name: 3-ethyl-2-{(Z)-[(5E)-5-[(2Z)-2-(1-ethylquinolin-4(1H)-ylidene)ethylidene]-4-oxo-3-(prop-2-en-1-yl)-1,3-thiazolidin-2-ylidene]methyl}-4,5-diphenyl-1,3-thiazol-3-ium
Smiles: C=CCn1/c(=C/c2sc(c([n+]2CC)c2ccccc2)c2ccccc2)/s/c(=C/C=c\2/ccn(c3c2cccc3)CC)/c1=O

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Saltdata: Br-
Molecular Weight: 600.83
Empirical Formula: C37H34N3OS2

Physical State: Dry powder
Available Amount: 160 mg

Lipinsky:
logP: 0
Rotatable bonds: 6
H-donors: 0
H-acceptors: 1
PSA: 80
Number of rings: 6

     

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