COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK143580
Chemical Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-chloro-2,5-dimethoxyphenyl)thiourea
Smiles: COc1cc(Cl)c(cc1NC(=S)NCc1ccc2c(c1)OCO2)OC

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Molecular Weight: 380.85
Empirical Formula: C17H17ClN2O4S

Physical State: Dry powder
Available Amount: 131 mg

Lipinsky:
logP: 3.906
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 93
Number of rings: 3

     

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