COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK446090
Chemical Name: 4-(1,3-benzodioxol-5-yl)-5-{[(4-methylbenzyl)sulfanyl]methyl}-4H-1,2,4-triazole-3-thiol
Smiles: Cc1ccc(cc1)CSCc1nnc(n1c1ccc2c(c1)OCO2)S

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Molecular Weight: 371.48
Empirical Formula: C18H17N3O2S2

Physical State: Dry powder
Available Amount: 738 mg

Lipinsky:
logP: 5.552
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 113
Number of rings: 4

     

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