COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK068355
Chemical Name: (2E)-4-{[1-(4-chlorophenyl)-2,5-dioxopyrrolidin-3-yl][2-(4-methoxyphenyl)ethyl]amino}-4-oxobut-2-enoicacid
Smiles: COc1ccc(cc1)CCN(C1CC(=O)N(C1=O)c1ccc(cc1)Cl)C(=O)/C=C/C(=O)O

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Molecular Weight: 456.88
Empirical Formula: C23H21ClN2O6

Physical State: Dry powder
Available Amount: 507 mg

Lipinsky:
logP: 2.176
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 104
Number of rings: 3

     

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