COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL148106
Chemical Name: 6-[(3E)-3-[(4-chlorophenyl)(hydroxy)methylidene]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]hexanoicacid
Smiles: OC(=O)CCCCCN1C(c2cccc(c2)[N+](=O)[O-])/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C1=O

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Molecular Weight: 472.88
Empirical Formula: C23H21ClN2O7

Physical State: Dry powder
Available Amount: 311 mg

Lipinsky:
logP: 3.865
Rotatable bonds: 9
H-donors: 2
H-acceptors: 7
PSA: 140
Number of rings: 3

     

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