COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK809930
Chemical Name: {(5Z)-5-[5-bromo-1-(carboxymethyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}aceticacid
Smiles: OC(=O)CN1C(=S)S/C(=C/2\C(=O)N(c3c2cc(Br)cc3)CC(=O)O)/C1=O

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Molecular Weight: 457.28
Empirical Formula: C15H9BrN2O6S2

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 0.265
Rotatable bonds: 6
H-donors: 2
H-acceptors: 6
PSA: 172
Number of rings: 3

     

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