COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL037395
Chemical Name: 2-bromo-6-methoxy-4-[(E)-(2-{[(1-methyl-1H-3,1-benzimidazol-3-ium-2-yl)sulfanyl]acetyl}hydrazinylidene)methyl]phenolate
Smiles: COc1cc(/C=N/NC(=O)CSc2[nH+]c3c(n2C)cccc3)cc(c1[O-])Br

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Molecular Weight: 449.33
Empirical Formula: C18H17BrN4O3S

Physical State: Dry powder
Available Amount: 311 mg

Lipinsky:
logP: 5.566
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 118
Number of rings: 3

     

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