COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL036964
Chemical Name: 5-{(E)-[2-({[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-2-hydroxyphenolate
Smiles: COc1ccc(cc1)c1n[nH+]c(n1c1ccc(cc1)Cl)SCC(=O)N/N=C/c1ccc(c(c1)[O-])O

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Molecular Weight: 509.97
Empirical Formula: C24H20ClN5O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.215
Rotatable bonds: 6
H-donors: 3
H-acceptors: 4
PSA: 151
Number of rings: 4

     

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