COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK180074
Chemical Name: 2-[(1,1-dioxido-1,2-benzothiazol-3-yl)(4-methylphenyl)amino]ethyl(2E)-3-(4-methoxyphenyl)prop-2-enoate
Smiles: COc1ccc(cc1)/C=C/C(=O)OCCN(C1=NS(=O)(=O)c2c1cccc2)c1ccc(cc1)C

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Molecular Weight: 476.55
Empirical Formula: C26H24N2O5S

Physical State: Dry powder
Available Amount: 1061 mg

Lipinsky:
logP: 4.803
Rotatable bonds: 5
H-donors: 0
H-acceptors: 5
PSA: 85
Number of rings: 4

     

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