COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK561388
Chemical Name: (E)-[4-(benzyloxy)-2-methylphenyl]{1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxo-2-(3-phenoxyphenyl)pyrrolidin-3-ylidene}methanolate
Smiles: Cc1cc(OCc2ccccc2)ccc1/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)Oc1ccccc1)CCC[NH+]1CCOCC1)/[O-]

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Molecular Weight: 618.73
Empirical Formula: C38H38N2O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.086
Rotatable bonds: 9
H-donors: 1
H-acceptors: 6
PSA: 92
Number of rings: 6

     

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