COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL287249
Chemical Name: 1-[4-(1,1-dioxido-1,2-benzothiazol-3-yl)piperazin-1-yl]propan-2-yl4-bromobenzoate
Smiles: CC(OC(=O)c1ccc(cc1)Br)CN1CCN(CC1)C1=NS(=O)(=O)c2c1cccc2

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Molecular Weight: 492.39
Empirical Formula: C21H22BrN3O4S

Physical State: Dry powder
Available Amount: 152 mg

Lipinsky:
logP: 3.419
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 79
Number of rings: 4

     

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