Compound Selection

Formula: C11H12N2O

MW: 188.23

CAS: 60-80-0

MDL NUMBER: MFCD00003146

IUPAC: antipyrine

Smiles: c1(n(n(C)c(c1)C)c1ccccc1)=O

THERAPEUTIC CATEGORY: Analgesic, Antipyretic

VET THERAP CATEGORY: Antipyretic, Analgesics

ACCEPTORS: 1

DONORS: 0

ROTATION BONDS: 0

N+O: 3

Chiral Centers: 0

LogP: 2.26

LogS: -3.57

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