COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK143138
Chemical Name: 2-[(4-chlorobenzyl)amino]-N-(4-fluorophenyl)-4,4-dimethyl-6-oxocyclohex-1-ene-1-carbothioamide
Smiles: Fc1ccc(cc1)NC(=S)C1=C(NCc2ccc(cc2)Cl)CC(CC1=O)(C)C

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Molecular Weight: 416.95
Empirical Formula: C22H22ClFN2OS

Physical State: Dry powder
Available Amount: 162 mg

Lipinsky:
logP: 5.889
Rotatable bonds: 2
H-donors: 2
H-acceptors: 1
PSA: 73
Number of rings: 3

     

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