COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK565198
Chemical Name: (E)-(3-chloro-4-methoxyphenyl){1-[3-(diethylammonio)propyl]-2-(2,5-dimethoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: CC[NH+](CCCN1C(=O)C(=O)/C(=C(\c2ccc(c(c2)Cl)OC)/[O-])/C1c1cc(OC)ccc1OC)CC

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Molecular Weight: 517.02
Empirical Formula: C27H33ClN2O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.872
Rotatable bonds: 11
H-donors: 1
H-acceptors: 6
PSA: 92
Number of rings: 3

     

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