COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK030053
Chemical Name: 2-[(4-methoxybenzyl)amino]-4,4-dimethyl-6-oxo-N-phenylcyclohex-1-ene-1-carbothioamide
Smiles: COc1ccc(cc1)CNC1=C(C(=O)CC(C1)(C)C)C(=S)Nc1ccccc1

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Molecular Weight: 394.54
Empirical Formula: C23H26N2O2S

Physical State: Dry powder
Available Amount: 166 mg

Lipinsky:
logP: 4.762
Rotatable bonds: 2
H-donors: 2
H-acceptors: 2
PSA: 82
Number of rings: 3

     

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