COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK446999
Chemical Name: 1-[1-(2,6-dichlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea
Smiles: S=C(Nc1c(C)nn(c1C)Cc1c(Cl)cccc1Cl)Nc1ccc2c(c1)OCCO2

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Molecular Weight: 463.39
Empirical Formula: C21H20Cl2N4O2S

Physical State: Dry powder
Available Amount: 660 mg

Lipinsky:
logP: 4.505
Rotatable bonds: 1
H-donors: 2
H-acceptors: 2
PSA: 92
Number of rings: 4

     

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