COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK143405
Chemical Name: 4-(1,3-benzodioxol-5-ylmethyl)-N-(3-chloro-2-methylphenyl)piperazine-1-carbothioamide
Smiles: S=C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)Nc1cccc(c1C)Cl

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Molecular Weight: 403.93
Empirical Formula: C20H22ClN3O2S

Physical State: Dry powder
Available Amount: 129 mg

Lipinsky:
logP: 3.821
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 69
Number of rings: 4

     

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