COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK292837
Chemical Name: 2-(2-bromo-6-methoxy-4-{(E)-[3-(4-nitrobenzyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}phenoxy)-N-[3-(methylsulfanyl)phenyl]acetamide
Smiles: CSc1cccc(c1)NC(=O)COc1c(Br)cc(cc1OC)/C=C\1/SC(=O)N(C1=O)Cc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 644.52
Empirical Formula: C27H22BrN3O7S2

Physical State: Dry powder
Available Amount: 234 mg

Lipinsky:
logP: 6.192
Rotatable bonds: 7
H-donors: 1
H-acceptors: 7
PSA: 181
Number of rings: 4

     

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