COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL148448
Chemical Name: (E)-[4,5-dioxo-1-(2-phenylethyl)-2-(pyridinium-4-yl)pyrrolidin-3-ylidene](2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanolate
Smiles: CC1Oc2c(C1)cc(cc2)/C(=C/1\C(=O)C(=O)N(C1c1cc[nH+]cc1)CCc1ccccc1)/[O-]

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Molecular Weight: 440.5
Empirical Formula: C27H24N2O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.23
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 83
Number of rings: 5

     

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