COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK560576
Chemical Name: (E)-(2-methyl-2,3-dihydro-1-benzofuran-5-yl){1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxo-2-[3-(pentyloxy)phenyl]pyrrolidin-3-ylidene}methanolate
Smiles: CCCCCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\[O-])/C(=O)C(=O)N1CCC[NH+]1CCOCC1

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Molecular Weight: 548.68
Empirical Formula: C32H40N2O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.518
Rotatable bonds: 11
H-donors: 1
H-acceptors: 6
PSA: 92
Number of rings: 5

     

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