COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL133252
Chemical Name: methyl(2E)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-[(4-ethoxyphenyl)sulfonyl]prop-2-enoate
Smiles: CCOc1ccc(cc1)S(=O)(=O)/C(=C/Nc1ccc2c(c1)OCCO2)/C(=O)OC

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Molecular Weight: 419.46
Empirical Formula: C20H21NO7S

Physical State: Dry powder
Available Amount: 250 mg

Lipinsky:
logP: 2.832
Rotatable bonds: 4
H-donors: 1
H-acceptors: 7
PSA: 108
Number of rings: 3

     

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