COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK566226
Chemical Name: (E)-[5-(ethoxycarbonyl)-2,4-dimethyl-1H-pyrrol-3-yl]{1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxo-2-phenylpyrrolidin-3-ylidene}methanolate
Smiles: CCOC(=O)c1[nH]c(c(c1C)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1)CCC[NH+]1CCOCC1)/[O-])C

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Molecular Weight: 495.58
Empirical Formula: C27H33N3O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.454
Rotatable bonds: 8
H-donors: 2
H-acceptors: 6
PSA: 116
Number of rings: 4

     

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