COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK800644
Chemical Name: (5Z)-5-{[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-[(E)-2-phenylethenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Smiles: O=c1/c(=C/c2cn(nc2c2ccc3c(c2)OCCO3)c2ccccc2)/sc2n1nc(n2)/C=C/c1ccccc1

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Molecular Weight: 531.59
Empirical Formula: C30H21N5O3S

Physical State: Dry powder
Available Amount: 88 mg

Lipinsky:
logP: 7.085
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 109
Number of rings: 7

     

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