COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK815380
Chemical Name: (5E)-2-(2-chlorophenyl)-5-[4-(heptyloxy)-3-methoxybenzylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Smiles: CCCCCCCOc1ccc(cc1OC)/C=c\1/sc2n(c1=O)nc(n2)c1ccccc1Cl

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Molecular Weight: 484.02
Empirical Formula: C25H26ClN3O3S

Physical State: Dry powder
Available Amount: 403 mg

Lipinsky:
logP: 8.26
Rotatable bonds: 10
H-donors: 0
H-acceptors: 3
PSA: 91
Number of rings: 4

     

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