COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL299849
Chemical Name: ethyl1-{4-[(3,5-dimethoxyphenyl)amino]-1-[(2-methoxyethyl)amino]-1,4-dioxobutan-2-yl}-1H-1,2,3-triazole-4-carboxylate
Smiles: COCCNC(=O)C(n1nnc(c1)C(=O)OCC)CC(=O)Nc1cc(OC)cc(c1)OC

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Molecular Weight: 449.46
Empirical Formula: C20H27N5O7

Physical State: Dry powder
Available Amount: 128 mg

Lipinsky:
logP: 1.204
Rotatable bonds: 12
H-donors: 2
H-acceptors: 7
PSA: 142
Number of rings: 2

     

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