COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK710816
Chemical Name: {4-[(4-benzylpiperazin-1-yl)carbonothioyl]-2-methoxyphenoxy}aceticacid
Smiles: COc1cc(ccc1OCC(=O)O)C(=S)N1CCN(CC1)Cc1ccccc1

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Molecular Weight: 400.5
Empirical Formula: C21H24N2O4S

Physical State: Dry powder
Available Amount: 314 mg

Lipinsky:
logP: 2.228
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 94
Number of rings: 3

     

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