COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL150439
Chemical Name: (E)-{1-[3-(dimethylammonio)propyl]-4,5-dioxo-2-[4-(propan-2-yloxy)phenyl]pyrrolidin-3-ylidene}(phenyl)methanolate
Smiles: CC(Oc1ccc(cc1)C1/C(=C(/c2ccccc2)\[O-])/C(=O)C(=O)N1CCC[NH+](C)C)C

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Molecular Weight: 422.52
Empirical Formula: C25H30N2O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.222
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 74
Number of rings: 3

     

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