COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK566569
Chemical Name: 4-[(1Z)-1-(2-{[(1-ethyl-1H-3,1-benzimidazol-3-ium-2-yl)sulfanyl]acetyl}hydrazinylidene)propyl]phenolate
Smiles: CC/C(=N/NC(=O)CSc1[nH+]c2c(n1CC)cccc2)/c1ccc(cc1)[O-]

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Molecular Weight: 382.49
Empirical Formula: C20H22N4O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.576
Rotatable bonds: 6
H-donors: 2
H-acceptors: 2
PSA: 108
Number of rings: 3

     

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