COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK515941
Chemical Name: (5Z)-2-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-5-[4-(hexyloxy)-3-methoxybenzylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Smiles: CCCCCCOc1ccc(cc1OC)/C=c/1\sc2n(c1=O)nc(n2)/C=C/c1ccc(c(c1)OC)OC

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Molecular Weight: 521.64
Empirical Formula: C28H31N3O5S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 7.925
Rotatable bonds: 12
H-donors: 0
H-acceptors: 5
PSA: 110
Number of rings: 4

     

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