COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL221402
Chemical Name: 2-{3-[3-(tricyclo[3.3.1.1~3,7~]dec-1-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]propyl}-1H-isoindole-1,3(2H)-dione
Smiles: O=C1N(CCCc2sc3n(n2)c(nn3)C23CC4CC(C3)CC(C2)C4)C(=O)c2c1cccc2

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Molecular Weight: 447.56
Empirical Formula: C24H25N5O2S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.27
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 108
Number of rings: 8

     

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