COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL038034
Chemical Name: 4-{(E)-[2-({[5-(3,4-dimethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-2-methoxyphenolate
Smiles: COc1cc(ccc1OC)c1n[nH+]c(n1CC)SCC(=O)N/N=C/c1ccc(c(c1)OC)[O-]

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Molecular Weight: 471.54
Empirical Formula: C22H25N5O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.164
Rotatable bonds: 10
H-donors: 2
H-acceptors: 5
PSA: 149
Number of rings: 3

     

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