COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK883236
Chemical Name: (5Z)-5-{[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-[(E)-2-(3,4-dimethoxyphenyl)ethenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Smiles: COc1ccc(cc1OC)/C=C/c1nc2n(n1)c(=O)/c(=C/c1cn(nc1c1ccc3c(c1)OCCO3)c1ccccc1)/s2

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Saltdata: 1/5DMF
Molecular Weight: 591.65
Empirical Formula: C32H25N5O5S

Physical State: Dry powder
Available Amount: 90 mg

Lipinsky:
logP: 6.912
Rotatable bonds: 6
H-donors: 0
H-acceptors: 5
PSA: 127
Number of rings: 7

     

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