COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL150554
Chemical Name: (E)-[5-(methoxycarbonyl)-2,4-dimethyl-1H-pyrrol-3-yl]{1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxo-2-(3,4,5-trimethoxyphenyl)pyrrolidin-3-ylidene}methanolate
Smiles: COc1c(OC)cc(cc1OC)C1N(CC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1c(C)[nH]c(c1C)C(=O)OC)/[O-]

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Molecular Weight: 557.6
Empirical Formula: C28H35N3O9

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.237
Rotatable bonds: 8
H-donors: 2
H-acceptors: 9
PSA: 143
Number of rings: 4

     

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