COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL147786
Chemical Name: 2-methoxy-6-{(Z)-[2-({[5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}phenolate
Smiles: COc1ccc(cc1)c1n[nH+]c(n1c1ccccc1)SCC(=O)N/N=C\c1cccc(c1[O-])OC

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Molecular Weight: 489.55
Empirical Formula: C25H23N5O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.075
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 140
Number of rings: 4

     

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