COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL015443
Chemical Name: methyl2-{(5E)-5-[(5-bromo-1H-indol-3-yl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl}propanoate
Smiles: CC(C(=O)OC)N1C(=O)/C(=C\c2c[nH]c3c2cc(Br)cc3)/SC1=O

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Molecular Weight: 409.26
Empirical Formula: C16H13BrN2O4S

Physical State: Dry powder
Available Amount: 303 mg

Lipinsky:
logP: 3.799
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 104
Number of rings: 3

     

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