COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL287695
Chemical Name: 2-[(1,1-dioxido-1,2-benzothiazol-3-yl)(3-methylphenyl)amino]ethyl(2E)-3-(3-chlorophenyl)prop-2-enoate
Smiles: O=C(/C=C/c1cccc(c1)Cl)OCCN(C1=NS(=O)(=O)c2c1cccc2)c1cccc(c1)C

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Molecular Weight: 480.97
Empirical Formula: C25H21ClN2O4S

Physical State: Dry powder
Available Amount: 615 mg

Lipinsky:
logP: 5.463
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 76
Number of rings: 4

     

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