COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK135653
Chemical Name: 5-(4-methoxyphenyl)-2-{[(2-methylpropyl)amino]methylidene}cyclohexane-1,3-dione
Smiles: COc1ccc(cc1)C1CC(=O)/C(=C/NCC(C)C)/C(=O)C1

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Molecular Weight: 301.39
Empirical Formula: C18H23NO3

Physical State: Dry powder
Available Amount: 169 mg

Lipinsky:
logP: 2.32
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 55
Number of rings: 2

     

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