COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK102547
Chemical Name: 4-({[3-(2,4-dichlorophenyl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl)-2-methoxyphenylacetate
Smiles: COc1cc(/C=N/n2c(S)nnc2c2ccc(cc2Cl)Cl)ccc1OC(=O)C

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Molecular Weight: 437.31
Empirical Formula: C18H14Cl2N4O3S

Physical State: Dry powder
Available Amount: 108 mg

Lipinsky:
logP: 5.323
Rotatable bonds: 7
H-donors: 0
H-acceptors: 3
PSA: 117
Number of rings: 3

     

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