COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL350991
Chemical Name: 2-({3-[2-(3,4-dimethoxyphenyl)ethyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl}methyl)-1H-isoindole-1,3(2H)-dione
Smiles: COc1cc(CCc2nnc3n2nc(s3)CN2C(=O)c3c(C2=O)cccc3)ccc1OC

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Molecular Weight: 449.49
Empirical Formula: C22H19N5O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.932
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 127
Number of rings: 5

     

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