COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK111546
Chemical Name: 2-{2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}-1,2-benzothiazol-3(2H)-one1,1-dioxide
Smiles: COc1ccc(cc1)N1CCN(CC1)C(=O)CN1C(=O)c2c(S1(=O)=O)cccc2

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Saltdata: HCI
Molecular Weight: 415.47
Empirical Formula: C20H21N3O5S

Physical State: Dry powder
Available Amount: 1392 mg

Lipinsky:
logP: 0.873
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 95
Number of rings: 4

     

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