COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL003422
Chemical Name: 3-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]propylchloro(phenyl)acetate
Smiles: O=C(C(c1ccccc1)Cl)OCCCNC1=NS(=O)(=O)c2c1cccc2

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Molecular Weight: 392.86
Empirical Formula: C18H17ClN2O4S

Physical State: Dry powder
Available Amount: 1497 mg

Lipinsky:
logP: 2.862
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 85
Number of rings: 3

     

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