COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL374759
Chemical Name: (2E,5Z)-5-(2-bromo-4,5-dimethoxybenzylidene)-2-[(4-methoxyphenyl)imino]-3-methyl-1,3-thiazolidin-4-one
Smiles: COc1ccc(cc1)/N=C\1/S/C(=C\c2cc(OC)c(cc2Br)OC)/C(=O)N1C

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Molecular Weight: 463.35
Empirical Formula: C20H19BrN2O4S

Physical State: Dry powder
Available Amount: 800 mg

Lipinsky:
logP: 5.242
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 85
Number of rings: 3

     

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