COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL049789
Chemical Name: 3-[(3E)-3-[(2E)-1-hydroxy-3-phenylprop-2-en-1-ylidene]-2-(2-methoxyphenyl)-4,5-dioxopyrrolidin-1-yl]benzoicacid
Smiles: COc1ccccc1C1/C(=C(/C=C/c2ccccc2)\O)/C(=O)C(=O)N1c1cccc(c1)C(=O)O

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Molecular Weight: 455.47
Empirical Formula: C27H21NO6

Physical State: Dry powder
Available Amount: 240 mg

Lipinsky:
logP: 4.209
Rotatable bonds: 6
H-donors: 2
H-acceptors: 6
PSA: 104
Number of rings: 4

     

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