COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK559713
Chemical Name: (E)-{2-(1,3-benzodioxol-5-yl)-1-[2-(diethylammonio)ethyl]-4,5-dioxopyrrolidin-3-ylidene}[4-(propan-2-yloxy)phenyl]methanolate
Smiles: CC[NH+](CCN1C(c2ccc3c(c2)OCO3)/C(=C(/c2ccc(cc2)OC(C)C)\[O-])/C(=O)C1=O)CC

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Molecular Weight: 480.56
Empirical Formula: C27H32N2O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.052
Rotatable bonds: 7
H-donors: 1
H-acceptors: 6
PSA: 92
Number of rings: 4

     

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