COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK455425
Chemical Name: N-(4-chlorobenzyl)-4-[(4-chlorophenyl)sulfonyl]piperazine-1-carbothioamide
Smiles: Clc1ccc(cc1)CNC(=S)N1CCN(CC1)S(=O)(=O)c1ccc(cc1)Cl

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Molecular Weight: 444.41
Empirical Formula: C18H19Cl2N3O2S2

Physical State: Dry powder
Available Amount: 538 mg

Lipinsky:
logP: 4.22
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 93
Number of rings: 3

     

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