COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK201352
Chemical Name: 2-({(5E)-5-[(1-ethyl-2,5-dimethyl-1H-pyrrol-3-yl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl}methyl)benzonitrile
Smiles: N#Cc1ccccc1CN1C(=O)S/C(=C/c2cc(n(c2C)CC)C)/C1=O

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Molecular Weight: 365.46
Empirical Formula: C20H19N3O2S

Physical State: Dry powder
Available Amount: 363 mg

Lipinsky:
logP: 4.111
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 91
Number of rings: 3

     

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