COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK564180
Chemical Name: 4-[(3E)-3-[(4-chlorophenyl)(hydroxy)methylidene]-2-(4-hydroxy-3-methoxyphenyl)-4,5-dioxopyrrolidin-1-yl]butanoicacid
Smiles: COc1cc(ccc1O)C1N(CCCC(=O)O)C(=O)C(=O)/C/1=C(\c1ccc(cc1)Cl)/O

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Molecular Weight: 445.86
Empirical Formula: C22H20ClNO7

Physical State: Dry powder
Available Amount: 314 mg

Lipinsky:
logP: 2.573
Rotatable bonds: 9
H-donors: 3
H-acceptors: 7
PSA: 124
Number of rings: 3

     

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