COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK207047
Chemical Name: N-(4-acetylphenyl)-2-(benzylamino)-4,4-dimethyl-6-oxocyclohex-1-ene-1-carbothioamide
Smiles: CC(=O)c1ccc(cc1)NC(=S)C1=C(NCc2ccccc2)CC(CC1=O)(C)C

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Molecular Weight: 406.55
Empirical Formula: C24H26N2O2S

Physical State: Dry powder
Available Amount: 108 mg

Lipinsky:
logP: 4.727
Rotatable bonds: 2
H-donors: 2
H-acceptors: 2
PSA: 90
Number of rings: 3

     

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