COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK887692
Chemical Name: [(4E)-4-{4-[(2-cyanoethyl)(methyl)amino]benzylidene}-5-oxo-2-thioxo-1,3-thiazolidin-3-yl]aceticacid
Smiles: N#CCCN(c1ccc(cc1)/C=C/1\C(=O)SC(=S)N1CC(=O)O)C

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Molecular Weight: 361.45
Empirical Formula: C16H15N3O3S2

Physical State: Dry powder
Available Amount: 71 mg

Lipinsky:
logP: 2.537
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 142
Number of rings: 2

     

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