COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK560974
Chemical Name: 2-{(Z)-[2-({[5-(4-chlorophenyl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}benzoate
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)N/N=C\c2ccccc2C(=O)[O-])[nH+]nc1c1ccc(cc1)Cl

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Molecular Weight: 536.01
Empirical Formula: C26H22ClN5O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.293
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 148
Number of rings: 4

     

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