COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK741983
Chemical Name: 4-{[(5,5-dimethyl-3-oxocyclohex-1-en-1-yl)amino]methyl}benzoicacid
Smiles: O=C1C=C(NCc2ccc(cc2)C(=O)O)CC(C1)(C)C

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Molecular Weight: 273.33
Empirical Formula: C16H19NO3

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 2.744
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 66
Number of rings: 2

     

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