COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK280762
Chemical Name: 2-({(E)-[4-(benzyloxy)-3-bromo-5-methoxyphenyl]methylidene}amino)-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione
Smiles: COc1cc(/C=N/N2C(=O)C3C(C2=O)C2CCC3C=C2)cc(c1OCc1ccccc1)Br

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Molecular Weight: 495.37
Empirical Formula: C25H23BrN2O4

Physical State: Dry powder
Available Amount: 117 mg

Lipinsky:
logP: 4.706
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 68
Number of rings: 6

     

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