COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL291044
Chemical Name: 4-[(1,1-dioxido-1,2-benzothiazol-3-yl)(methyl)amino]phenyl2-bromobutanoate
Smiles: CCC(C(=O)Oc1ccc(cc1)N(C1=NS(=O)(=O)c2c1cccc2)C)Br

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Molecular Weight: 437.31
Empirical Formula: C18H17BrN2O4S

Physical State: Dry powder
Available Amount: 1663 mg

Lipinsky:
logP: 2.22
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 76
Number of rings: 3

     

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