COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK181102
Chemical Name: 2-[4-(1,1-dioxido-1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl3-methylbenzoate
Smiles: Cc1cccc(c1)C(=O)OCCN1CCN(CC1)C1=NS(=O)(=O)c2c1cccc2

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Molecular Weight: 413.5
Empirical Formula: C21H23N3O4S

Physical State: Dry powder
Available Amount: 795 mg

Lipinsky:
logP: 2.78
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 79
Number of rings: 4

     

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