COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK971335
Chemical Name: 3-{[4-oxo-3,5-di(propan-2-yl)cyclohexa-2,5-dien-1-ylidene]amino}benzoicacid
Smiles: CC(C1=C/C(=N/c2cccc(c2)C(=O)O)/C=C(C1=O)C(C)C)C

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Molecular Weight: 311.38
Empirical Formula: C19H21NO3

Available Amount: 0 mg

Lipinsky:
logP: 4.785
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 66
Number of rings: 2

     

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