COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL150002
Chemical Name: (E)-{2-(furan-2-yl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}{4-[(2-methylbenzyl)oxy]phenyl}methanolate
Smiles: O=C1C(=O)/C(=C(\c2ccc(cc2)OCc2ccccc2C)/[O-])/C(N1CCC[NH+]1CCOCC1)c1ccco1

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Molecular Weight: 516.59
Empirical Formula: C30H32N2O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.256
Rotatable bonds: 7
H-donors: 1
H-acceptors: 6
PSA: 96
Number of rings: 5

     

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