COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK465455
Chemical Name: 3-({[2-(1,3-benzodioxol-5-yl)-1,3-thiazol-4-yl]methyl}sulfanyl)-5-cyclopentyl-4-ethyl-4H-1,2,4-triazole
Smiles: CCn1c(SCc2csc(n2)c2ccc3c(c2)OCO3)nnc1C1CCCC1

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Molecular Weight: 414.55
Empirical Formula: C20H22N4O2S2

Physical State: Dry powder
Available Amount: 231 mg

Lipinsky:
logP: 4.911
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 115
Number of rings: 5

     

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