COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL147469
Chemical Name: (E)-(7-methoxy-1-benzofuran-2-yl){1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxo-2-(3,4,5-trimethoxyphenyl)pyrrolidin-3-ylidene}methanolate
Smiles: COc1c(OC)cc(cc1OC)C1/C(=C(/c2oc3c(c2)cccc3OC)\[O-])/C(=O)C(=O)N1CCC[NH+]1CCOCC1

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Molecular Weight: 566.61
Empirical Formula: C30H34N2O9

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.74
Rotatable bonds: 8
H-donors: 1
H-acceptors: 9
PSA: 124
Number of rings: 5

     

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