COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK635067
Chemical Name: 3-{[3-(5-chloro-2-hydroxyphenyl)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl]methyl}benzoicacid
Smiles: Clc1ccc(c(c1)c1n[nH]c(=S)n1Cc1cccc(c1)C(=O)O)O

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Molecular Weight: 361.81
Empirical Formula: C16H12ClN3O3S

Physical State: Dry powder
Available Amount: 324 mg

Lipinsky:
logP: 2.236
Rotatable bonds: 6
H-donors: 3
H-acceptors: 3
PSA: 117
Number of rings: 3

     

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