COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL125474
Chemical Name: 2-[(3E)-4-(dimethylamino)-2-oxobut-3-en-1-yl]-1H-isoindole-1,3(2H)-dione
Smiles: CN(/C=C/C(=O)CN1C(=O)c2c(C1=O)cccc2)C

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Molecular Weight: 258.28
Empirical Formula: C14H14N2O3

Physical State: Dry powder
Available Amount: 255 mg

Lipinsky:
logP: 2.244
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 57
Number of rings: 2

     

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