COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK456098
Chemical Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[3,5-dimethyl-1-(pentafluorobenzyl)-1H-pyrazol-4-yl]thiourea
Smiles: COc1ccc(cc1OC)CCNC(=S)Nc1c(C)nn(c1C)Cc1c(F)c(F)c(c(c1F)F)F

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Molecular Weight: 514.52
Empirical Formula: C23H23F5N4O2S

Physical State: Dry powder
Available Amount: 715 mg

Lipinsky:
logP: 3.923
Rotatable bonds: 6
H-donors: 2
H-acceptors: 2
PSA: 92
Number of rings: 3

     

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