COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL150022
Chemical Name: 2-{(E)-[2-({[5-(benzylsulfanyl)-1,3,4-thiadiazol-4-ium-2-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-6-(prop-2-en-1-yl)phenolate
Smiles: C=CCc1cccc(c1[O-])/C=N/NC(=O)CSc1n[nH+]c(s1)SCc1ccccc1

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Molecular Weight: 456.61
Empirical Formula: C21H20N4O2S3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.191
Rotatable bonds: 9
H-donors: 2
H-acceptors: 2
PSA: 170
Number of rings: 3

     

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