COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL380669
Chemical Name: {4-bromo-2-[(E)-(3-{2-[(2-methylphenyl)amino]-2-oxoethyl}-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]phenoxy}aceticacid
Smiles: O=C(Nc1ccccc1C)CN1C(=O)S/C(=C/c2cc(Br)ccc2OCC(=O)O)/C1=O

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Molecular Weight: 505.35
Empirical Formula: C21H17BrN2O6S

Physical State: Dry powder
Available Amount: 960 mg

Lipinsky:
logP: 4.341
Rotatable bonds: 7
H-donors: 2
H-acceptors: 6
PSA: 138
Number of rings: 3

     

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