COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL148766
Chemical Name: (E)-(3-chloro-4-methoxyphenyl){1-[3-(diethylammonio)propyl]-2-(3,4-dimethoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: COc1cc(ccc1OC)C1N(CCC[NH+](CC)CC)C(=O)C(=O)/C/1=C(\c1ccc(c(c1)Cl)OC)/[O-]

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Molecular Weight: 517.02
Empirical Formula: C27H33ClN2O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.728
Rotatable bonds: 11
H-donors: 1
H-acceptors: 6
PSA: 92
Number of rings: 3

     

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