COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK446643
Chemical Name: S-{5-[(4-chloro-3,5-dimethylphenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}4-chlorobenzenecarbothioate
Smiles: Clc1ccc(cc1)C(=O)Sc1nnc(n1C)COc1cc(C)c(c(c1)C)Cl

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Molecular Weight: 422.33
Empirical Formula: C19H17Cl2N3O2S

Physical State: Dry powder
Available Amount: 426 mg

Lipinsky:
logP: 6.031
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 82
Number of rings: 3

     

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