COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL147901
Chemical Name: 2-[(E)-{2-[({5-[(4-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetyl]hydrazinylidene}methyl]-5-(diethylammonio)phenolate
Smiles: CC[NH+](c1ccc(c(c1)[O-])/C=N/NC(=O)CSc1nnc(s1)SCc1ccc(cc1)Cl)CC

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Molecular Weight: 522.12
Empirical Formula: C22H24ClN5O2S3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.97
Rotatable bonds: 9
H-donors: 2
H-acceptors: 2
PSA: 173
Number of rings: 3

     

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