COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK458011
Chemical Name: 1-[3,5-dimethyl-1-(2-methylbenzyl)-1H-pyrazol-4-yl]-3-(4-ethoxyphenyl)thiourea
Smiles: CCOc1ccc(cc1)NC(=S)Nc1c(C)nn(c1C)Cc1ccccc1C

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Molecular Weight: 394.54
Empirical Formula: C22H26N4OS

Physical State: Dry powder
Available Amount: 274 mg

Lipinsky:
logP: 4.2
Rotatable bonds: 3
H-donors: 2
H-acceptors: 1
PSA: 83
Number of rings: 3

     

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