COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK496109
Chemical Name: 3-({[2-(1,3-benzodioxol-5-yl)-1,3-thiazol-4-yl]methyl}sulfanyl)-5-(1-benzothiophen-3-yl)-4-methyl-4H-1,2,4-triazole
Smiles: Cn1c(SCc2csc(n2)c2ccc3c(c2)OCO3)nnc1c1csc2c1cccc2

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Molecular Weight: 464.59
Empirical Formula: C22H16N4O2S3

Physical State: Dry powder
Available Amount: 231 mg

Lipinsky:
logP: 7.236
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 143
Number of rings: 6

     

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