COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK559028
Chemical Name: (E)-(3-chloro-4-methoxyphenyl)[2-(4-methylphenyl)-4,5-dioxo-1-(pyridinium-2-yl)pyrrolidin-3-ylidene]methanolate
Smiles: COc1ccc(cc1Cl)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)C)c1cccc[nH+]1)/[O-]

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Molecular Weight: 434.88
Empirical Formula: C24H19ClN2O4

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 4.277
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 83
Number of rings: 4

     

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