COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL287652
Chemical Name: (2E)-3-(3-chlorophenyl)-N-{3-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]propyl}prop-2-enamide
Smiles: O=C(/C=C/c1cccc(c1)Cl)NCCCNC1=NS(=O)(=O)c2c1cccc2

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Molecular Weight: 403.89
Empirical Formula: C19H18ClN3O3S

Physical State: Dry powder
Available Amount: 265 mg

Lipinsky:
logP: 2.778
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 88
Number of rings: 3

     

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