COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK565414
Chemical Name: (E)-(7-methoxy-1-benzofuran-2-yl){2-(2-methoxyphenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: COc1ccccc1C1N(CC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1cc2c(o1)c(OC)ccc2)/[O-]

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Molecular Weight: 492.53
Empirical Formula: C27H28N2O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.092
Rotatable bonds: 7
H-donors: 1
H-acceptors: 7
PSA: 105
Number of rings: 5

     

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