COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK456365
Chemical Name: 1-[1-(2,4-dichlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-3-(3,4-dimethoxyphenyl)thiourea
Smiles: COc1ccc(cc1OC)NC(=S)Nc1c(C)nn(c1C)Cc1ccc(cc1Cl)Cl

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Molecular Weight: 465.4
Empirical Formula: C21H22Cl2N4O2S

Physical State: Dry powder
Available Amount: 921 mg

Lipinsky:
logP: 4.577
Rotatable bonds: 4
H-donors: 2
H-acceptors: 2
PSA: 92
Number of rings: 3

     

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