COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK415077
Chemical Name: 4-(1,3-benzodioxol-5-ylmethyl)-N-(2-ethylphenyl)piperazine-1-carbothioamide
Smiles: CCc1ccccc1NC(=S)N1CCN(CC1)Cc1ccc2c(c1)OCO2

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Molecular Weight: 383.51
Empirical Formula: C21H25N3O2S

Physical State: Dry powder
Available Amount: 486 mg

Lipinsky:
logP: 3.322
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 69
Number of rings: 4

     

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