COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL261030
Chemical Name: dimethyl5-{[(3,4-diethoxyphenyl)carbonyl]amino}benzene-1,3-dicarboxylate-dimethyl5-aminobenzene-1,3-dicarboxylate(1:1)
Smiles: COC(=O)c1cc(N)cc(c1)C(=O)OC.CCOc1cc(ccc1OCC)C(=O)Nc1cc(cc(c1)C(=O)OC)C(=O)OC

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Molecular Weight: 610.62
Empirical Formula: C31H34N2O11

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 0
Rotatable bonds: 13
H-donors: 3
H-acceptors: 11
PSA: 178
Number of rings: 3

     

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