COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK704079
Chemical Name: (5E)-2-(2,3-dihydro-1,4-benzodioxin-2-yl)-5-{[5-(3-nitrophenyl)furan-2-yl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Smiles: [O-][N+](=O)c1cccc(c1)c1ccc(o1)/C=c\1/sc2n(c1=O)nc(n2)C1COc2c(O1)cccc2

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Molecular Weight: 474.45
Empirical Formula: C23H14N4O6S

Physical State: Dry powder
Available Amount: 98 mg

Lipinsky:
logP: 5.113
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 150
Number of rings: 6

     

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