COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK486806
Chemical Name: 1-(1,3-benzodioxol-5-yl)-3-[1-(2-chloro-6-fluorobenzyl)-1H-pyrazol-3-yl]thiourea
Smiles: S=C(Nc1ccn(n1)Cc1c(F)cccc1Cl)Nc1ccc2c(c1)OCO2

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Molecular Weight: 404.85
Empirical Formula: C18H14ClFN4O2S

Physical State: Dry powder
Available Amount: 239 mg

Lipinsky:
logP: 2.985
Rotatable bonds: 2
H-donors: 2
H-acceptors: 2
PSA: 92
Number of rings: 4

     

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