COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK564993
Chemical Name: (E)-(4-chlorophenyl){2-(2,5-dimethoxyphenyl)-1-[2-(dimethylammonio)ethyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: COc1ccc(cc1C1N(CC[NH+](C)C)C(=O)C(=O)/C/1=C(\c1ccc(cc1)Cl)/[O-])OC

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Molecular Weight: 444.91
Empirical Formula: C23H25ClN2O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.709
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 83
Number of rings: 3

     

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