COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK566767
Chemical Name: (E)-(4-methoxy-2-methylphenyl){1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxo-2-(3,4,5-trimethoxyphenyl)pyrrolidin-3-ylidene}methanolate
Smiles: COc1ccc(c(c1)C)/C(=C/1\C(=O)C(=O)N(C1c1cc(OC)c(c(c1)OC)OC)CCC[NH+]1CCOCC1)/[O-]

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Molecular Weight: 540.61
Empirical Formula: C29H36N2O8

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.878
Rotatable bonds: 8
H-donors: 1
H-acceptors: 8
PSA: 111
Number of rings: 4

     

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