COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK565194
Chemical Name: 4-{(E)-[2-({[4-(4-chlorophenyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-3-hydroxyphenolate
Smiles: O=C(CSc1[nH+]nc(n1c1ccc(cc1)Cl)c1ccc(cc1)C)N/N=C/c1ccc(cc1O)[O-]

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Molecular Weight: 493.97
Empirical Formula: C24H20ClN5O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.857
Rotatable bonds: 6
H-donors: 3
H-acceptors: 3
PSA: 142
Number of rings: 4

     

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