COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK785928
Chemical Name: 5-[3-(3-tert-butyl-1H-pyrazol-5-yl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]-2-chlorobenzoicacid
Smiles: Sc1nnc(n1c1ccc(c(c1)C(=O)O)Cl)c1[nH]nc(c1)C(C)(C)C

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Molecular Weight: 377.85
Empirical Formula: C16H16ClN5O2S

Physical State: Dry powder
Available Amount: 2 mg

Lipinsky:
logP: 4.339
Rotatable bonds: 4
H-donors: 2
H-acceptors: 2
PSA: 135
Number of rings: 3

     

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