COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL335677
Chemical Name: dimethyl(3E,3'E)-3,3'-{benzene-1,4-diylbis[imino(E)methylylidene]}bis(6,6-dimethyl-2,4-dioxocyclohexanecarboxylate)
Smiles: COC(=O)C1C(=O)/C(=C/Nc2ccc(cc2)N/C=C/2\C(=O)CC(C(C2=O)C(=O)OC)(C)C)/C(=O)CC1(C)C

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Molecular Weight: 524.57
Empirical Formula: C28H32N2O8

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.193
Rotatable bonds: 4
H-donors: 2
H-acceptors: 8
PSA: 144
Number of rings: 3

     

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