COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK559038
Chemical Name: 2-[(E)-{2-[({5-[(4-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-4-ium-2-yl}sulfanyl)acetyl]hydrazinylidene}methyl]-6-ethoxyphenolate
Smiles: CCOc1cccc(c1[O-])/C=N/NC(=O)CSc1n[nH+]c(s1)SCc1ccc(cc1)Cl

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Molecular Weight: 495.05
Empirical Formula: C20H19ClN4O3S3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.176
Rotatable bonds: 9
H-donors: 2
H-acceptors: 3
PSA: 179
Number of rings: 3

     

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