Compound Selection

Formula: C13H21NO3

MW: 239.31

Salt: 0.5 H2SO4

IUPAC: 4-[(1S)-1-hydroxy-2-(propylamino)ethyl]-2-(hydroxymethyl)phenol, oxamethane

Smiles: c1cc(cc(c1O)CO)C(CNC(C)(C)C)O

THERAPEUTIC CATEGORY: Bronchodilator; tocolytic

ACCEPTORS: 3

DONORS: 4

ROTATION BONDS: 6

N+O: 4

Chiral Centers: 0

LogP: 0.77

LogS: -3.03

LIPINSKI: 4

Chemical Compounds - BioActive Compounds

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MyriaScreen II – diversity screening library from Sigma-Aldrich and TimTec
ApexScreen is a collection of 5,040 compounds that were selected to represent the diversity of TimTec stock
Chemistry reagents, HPLC columns, natural compounds
innovative software packages for chemical database management, chemical web server, structure drawing, diversity analysis, clustering, HTS and combinatorial chemistry, prediction of LogP/solubility/Pk, and Spectra Management