COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK565022
Chemical Name: (E)-{2-(2,5-dimethoxyphenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}[4-(propan-2-yloxy)phenyl]methanolate
Smiles: COc1ccc(cc1C1N(CC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OC(C)C)/[O-])OC

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Molecular Weight: 510.59
Empirical Formula: C28H34N2O7

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 3.614
Rotatable bonds: 7
H-donors: 1
H-acceptors: 7
PSA: 101
Number of rings: 4

     

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