COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK114369
Chemical Name: (2E,5E)-5-{4-[(2-chlorobenzyl)oxy]-3-ethoxy-5-(prop-2-en-1-yl)benzylidene}-2-(phenylimino)-3-(pyridin-3-ylmethyl)-1,3-thiazolidin-4-one
Smiles: C=CCc1cc(/C=C\2/S/C(=N/c3ccccc3)/N(C2=O)Cc2cccnc2)cc(c1OCc1ccccc1Cl)OCC

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Molecular Weight: 596.15
Empirical Formula: C34H30ClN3O3S

Physical State: Dry powder
Available Amount: 248 mg

Lipinsky:
logP: 8.408
Rotatable bonds: 10
H-donors: 0
H-acceptors: 3
PSA: 89
Number of rings: 5

     

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