COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL037904
Chemical Name: (E)-(4-methylphenyl){1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxo-2-[4-(propan-2-yloxy)phenyl]pyrrolidin-3-ylidene}methanolate
Smiles: CC(Oc1ccc(cc1)C1/C(=C(/c2ccc(cc2)C)\[O-])/C(=O)C(=O)N1CCC[NH+]1CCOCC1)C

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Molecular Weight: 478.59
Empirical Formula: C28H34N2O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.288
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 83
Number of rings: 4

     

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