COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK264395
Chemical Name: 3-[5,6-bis(1,3-benzodioxol-5-yl)-1,3,8-trioxo-4,7-diphenyl-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl]benzoicacid
Smiles: OC(=O)c1cccc(c1)N1C(=O)C2C(C1=O)C1(C(=O)C2(c2ccccc2)C(=C1c1ccc2c(c1)OCO2)c1ccc2c(c1)OCO2)c1ccccc1

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Molecular Weight: 689.68
Empirical Formula: C42H27NO9

Physical State: Dry powder
Available Amount: 75 mg

Lipinsky:
logP: 8.536
Rotatable bonds: 4
H-donors: 1
H-acceptors: 9
PSA: 128
Number of rings: 10

     

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