COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK450287
Chemical Name: 5-[1-(1,3-benzodioxol-5-yloxy)ethyl]-4-(4-chlorobenzyl)-4H-1,2,4-triazole-3-thiol
Smiles: Clc1ccc(cc1)Cn1c(S)nnc1C(Oc1ccc2c(c1)OCO2)C

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Molecular Weight: 389.86
Empirical Formula: C18H16ClN3O3S

Physical State: Dry powder
Available Amount: 162 mg

Lipinsky:
logP: 4.783
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 97
Number of rings: 4

     

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