COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK704076
Chemical Name: (5Z)-2-(2,3-dihydro-1,4-benzodioxin-2-yl)-5-{[1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-4-yl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Smiles: O=c1/c(=C/c2cn(nc2c2cccs2)c2ccccc2)/sc2n1nc(n2)C1COc2c(O1)cccc2

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Molecular Weight: 511.58
Empirical Formula: C26H17N5O3S2

Physical State: Dry powder
Available Amount: 96 mg

Lipinsky:
logP: 6.033
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 137
Number of rings: 7

     

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