COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL047226
Chemical Name: 4-bromo-2-[(E)-(2-{[(1-methyl-1H-3,1-benzimidazol-3-ium-2-yl)sulfanyl]acetyl}hydrazinylidene)methyl]phenolate
Smiles: O=C(CSc1[nH+]c2c(n1C)cccc2)N/N=C/c1cc(Br)ccc1[O-]

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Molecular Weight: 419.3
Empirical Formula: C17H15BrN4O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.914
Rotatable bonds: 5
H-donors: 2
H-acceptors: 2
PSA: 108
Number of rings: 3

     

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