COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL148264
Chemical Name: 4-{[(E)-(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]amino}-5-(2,4-dichlorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(/C=N/n2c(=S)[nH]nc2c2ccc(cc2Cl)Cl)cc(c1O)Br

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Molecular Weight: 474.16
Empirical Formula: C16H11BrCl2N4O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.805
Rotatable bonds: 5
H-donors: 2
H-acceptors: 2
PSA: 101
Number of rings: 3

     

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