COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK295954
Chemical Name: 5,5'-[propane-2,2-diylbis(benzene-4,1-diyloxy)]bis[2-(3-ethynylphenyl)-1H-isoindole-1,3(2H)-dione]
Smiles: C#Cc1cccc(c1)N1C(=O)c2c(C1=O)cc(cc2)Oc1ccc(cc1)C(c1ccc(cc1)Oc1ccc2c(c1)C(=O)N(C2=O)c1cccc(c1)C#C)(C)C

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Molecular Weight: 718.77
Empirical Formula: C47H30N2O6

Physical State: Dry powder
Available Amount: 149 mg

Lipinsky:
logP: 9.614
Rotatable bonds: 2
H-donors: 0
H-acceptors: 6
PSA: 93
Number of rings: 8

     

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