COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK467540
Chemical Name: 3-({[2-(1,3-benzodioxol-5-yl)-1,3-thiazol-4-yl]methyl}sulfanyl)-5-(4-methoxybenzyl)-4-methyl-4H-1,2,4-triazole
Smiles: COc1ccc(cc1)Cc1nnc(n1C)SCc1csc(n1)c1ccc2c(c1)OCO2

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Molecular Weight: 452.56
Empirical Formula: C22H20N4O3S2

Physical State: Dry powder
Available Amount: 431 mg

Lipinsky:
logP: 4.577
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 124
Number of rings: 5

     

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