COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK570642
Chemical Name: 3-[(3E)-3-[(2E)-1-hydroxy-3-phenylprop-2-en-1-ylidene]-2-(3-methoxyphenyl)-4,5-dioxopyrrolidin-1-yl]benzoicacid
Smiles: COc1cccc(c1)C1N(c2cccc(c2)C(=O)O)C(=O)C(=O)/C/1=C(\C=C\c1ccccc1)/O

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Molecular Weight: 455.47
Empirical Formula: C27H21NO6

Physical State: Dry powder
Available Amount: 313 mg

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

     

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