COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL026723
Chemical Name: 4-{(3E)-5-bromo-3-[3-(carboxymethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]-2-oxo-2,3-dihydro-1H-indol-1-yl}butanoicacid
Smiles: OC(=O)CCCN1C(=O)/C(=C\2/SC(=S)N(C2=O)CC(=O)O)/c2c1ccc(c2)Br

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Molecular Weight: 485.34
Empirical Formula: C17H13BrN2O6S2

Available Amount: 0 mg

Lipinsky:
logP: 0.65
Rotatable bonds: 8
H-donors: 2
H-acceptors: 6
PSA: 172
Number of rings: 3

     

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