COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK298097
Chemical Name: 2-(2-{3-[4-(dimethylamino)phenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl}ethyl)-1H-isoindole-1,3(2H)-dione
Smiles: CN(c1ccc(cc1)c1nnc2n1nc(s2)CCN1C(=O)c2c(C1=O)cccc2)C

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Molecular Weight: 418.48
Empirical Formula: C21H18N6O2S

Physical State: Dry powder
Available Amount: 451 mg

Lipinsky:
logP: 4.777
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 111
Number of rings: 5

     

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