COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL043930
Chemical Name: 2,6-dimethoxy-4-[(E)-(2-{[(4-methyl-4H-1,2,4-triazol-2-ium-3-yl)sulfanyl]acetyl}hydrazinylidene)methyl]phenolate
Smiles: COc1cc(/C=N/NC(=O)CSc2[nH+]ncn2C)cc(c1[O-])OC

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Molecular Weight: 351.39
Empirical Formula: C14H17N5O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.708
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 140
Number of rings: 2

     

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