COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK913810
Chemical Name: 2-{5-[3-(morpholin-4-ylmethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]pentyl}-1H-isoindole-1,3(2H)-dione
Smiles: O=C1N(CCCCCc2sc3n(n2)c(nn3)CN2CCOCC2)C(=O)c2c1cccc2

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Molecular Weight: 440.53
Empirical Formula: C21H24N6O3S

Physical State: Dry powder
Available Amount: 422 mg

Lipinsky:
logP: 2.849
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 121
Number of rings: 5

     

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