COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK268315
Chemical Name: 2-(3-nitrophenyl)-2-oxoethyl2-(5,6-dibromo-1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)-3-methylbutanoate
Smiles: CC(C(N1C(=O)C2C(C1=O)C1CC2C(C1Br)Br)C(=O)OCC(=O)c1cccc(c1)[N+](=O)[O-])C

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Molecular Weight: 586.23
Empirical Formula: C22H22Br2N2O7

Physical State: Dry powder
Available Amount: 136 mg

Lipinsky:
logP: 4.106
Rotatable bonds: 6
H-donors: 0
H-acceptors: 7
PSA: 126
Number of rings: 4

     

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