COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK133051
Chemical Name: 2-{3-[4-(2-methoxyphenyl)piperazin-1-yl]-3-oxopropyl}-1,2-benzothiazol-3(2H)-one1,1-dioxide
Smiles: COc1ccccc1N1CCN(CC1)C(=O)CCN1C(=O)c2c(S1(=O)=O)cccc2

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Saltdata: HCl
Molecular Weight: 429.5
Empirical Formula: C21H23N3O5S

Physical State: Dry powder
Available Amount: 1214 mg

Lipinsky:
logP: 1.252
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 95
Number of rings: 4

     

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