COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL054255
Chemical Name: (E)-[2-(4-ethoxy-3-methoxyphenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene][4-(propan-2-yloxy)phenyl]methanolate
Smiles: CCOc1ccc(cc1OC)C1/C(=C(/c2ccc(cc2)OC(C)C)\[O-])/C(=O)C(=O)N1Cc1ccc[nH+]c1

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Molecular Weight: 502.57
Empirical Formula: C29H30N2O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.489
Rotatable bonds: 7
H-donors: 1
H-acceptors: 6
PSA: 102
Number of rings: 4

     

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