Compound Selection

Formula: C13H20N2O2

MW: 236.31

 

CAS: 17692-31-8

 

MDL NUMBER: MFCD00079124

IUPAC: 3-(4-phenylpiperazinyl)propane-1,2-diol

Smiles: N1(CCN(CC(O)CO)CC1)c1ccccc1

 

IInfluences cough reflex

THERAPEUTIC CATEGORY: Antitussive

 

 

 

 

ACCEPTORS: 2

DONORS: 2

ROTATION BONDS: 4

N+O: 4

Chiral Centers: 1

LogP: 0.42

LogS: -3.14

LIPINSKI: 4

 

 

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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