COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK050545
Chemical Name: (2E)-4-{[1-(3-chlorophenyl)-2,5-dioxopyrrolidin-3-yl][2-(4-sulfamoylphenyl)ethyl]amino}-4-oxobut-2-enoicacid
Smiles: OC(=O)/C=C/C(=O)N(C1CC(=O)N(C1=O)c1cccc(c1)Cl)CCc1ccc(cc1)S(=O)(=O)N

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Molecular Weight: 505.94
Empirical Formula: C22H20ClN3O7S

Physical State: Dry powder
Available Amount: 333 mg

Lipinsky:
logP: 0.218
Rotatable bonds: 6
H-donors: 3
H-acceptors: 7
PSA: 163
Number of rings: 3

     

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