COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL509744
Chemical Name: 2-[1-{[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]amino}-2-(4-methoxyphenyl)-2-oxoethyl]-3-hydroxy-6-methyl-4H-pyran-4-one
Smiles: COc1ccc(cc1)C(=O)C(c1oc(C)cc(=O)c1O)NCCc1cc(OC)c(cc1[N+](=O)[O-])OC

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Molecular Weight: 498.49
Empirical Formula: C25H26N2O9

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.902
Rotatable bonds: 9
H-donors: 2
H-acceptors: 9
PSA: 149
Number of rings: 3

     

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