COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK296339
Chemical Name: 2,2'-(benzene-1,4-diylbis{[(1E)-3-oxoprop-1-ene-1,3-diyl]benzene-3,1-diyl})bis(4,5,6,7-tetrabromo-1H-isoindole-1,3(2H)-dione)
Smiles: O=C(c1cccc(c1)N1C(=O)c2c(C1=O)c(Br)c(c(c2Br)Br)Br)/C=C/c1ccc(cc1)/C=C/C(=O)c1cccc(c1)N1C(=O)c2c(C1=O)c(Br)c(c(c2Br)Br)Br

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Molecular Weight: 1259.81
Empirical Formula: C40H16Br8N2O6

Physical State: Dry powder
Available Amount: 70 mg

Lipinsky:
logP: 11.414
Rotatable bonds: 4
H-donors: 0
H-acceptors: 6
PSA: 108
Number of rings: 7

     

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