COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL046904
Chemical Name: (E)-[2-methyl-4-(2-methylpropoxy)phenyl]{2-(4-methylphenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: CC(COc1ccc(c(c1)C)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)C)CCC[NH+]1CCOCC1)/[O-])C

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Molecular Weight: 506.64
Empirical Formula: C30H38N2O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.31
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 83
Number of rings: 4

     

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