COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK295944
Chemical Name: 2,2'-(benzene-1,4-diylbis{[(1E)-3-oxoprop-1-ene-1,3-diyl]benzene-3,1-diyl})bis(3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione)
Smiles: O=C1N(c2cccc(c2)C(=O)/C=C/c2ccc(cc2)/C=C/C(=O)c2cccc(c2)N2C(=O)C3C(C2=O)C2CC3C=C2)C(=O)C2C1C1C=CC2C1

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Molecular Weight: 660.73
Empirical Formula: C42H32N2O6

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.872
Rotatable bonds: 4
H-donors: 0
H-acceptors: 6
PSA: 108
Number of rings: 9

     

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