COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK455454
Chemical Name: N-(4-chlorobenzyl)-4-[(2E)-3-phenylprop-2-en-1-yl]piperazine-1-carbothioamide
Smiles: Clc1ccc(cc1)CNC(=S)N1CCN(CC1)C/C=C/c1ccccc1

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Molecular Weight: 385.96
Empirical Formula: C21H24ClN3S

Physical State: Dry powder
Available Amount: 724 mg

Lipinsky:
logP: 4.301
Rotatable bonds: 2
H-donors: 1
H-acceptors: 0
PSA: 50
Number of rings: 3

     

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