COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK631009
Chemical Name: 4-(1,3-benzodioxol-5-ylmethyl)-5-(3-chlorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Clc1cccc(c1)c1n[nH]c(=S)n1Cc1ccc2c(c1)OCO2

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Molecular Weight: 345.81
Empirical Formula: C16H12ClN3O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.809
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 78
Number of rings: 4

     

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