Compound Selection

Formula: C6H9N3O2

MW: 155.16

CAS: 351-50-8

MDL: MFCD00065963

TNP: TNP00411

H-D-HIS-OH; HISTIDINE, D-; D-ALPHA-AMINO-BETA-IMIDAZOLEPROPIONIC ACID; D-ALPHA-AMINO-BETA-(4-IMIDAZOLYL)PROPIONIC ACID; D-2-AMINO-3-(4-IMIDAZOLYL)PROPIONIC ACID; D-HIS-OH; D-HISTIDINE; D-HIS

LogP: 0.1

LogS: -5.71

Acceptors: 2

Donors: 4

Rotation Bonds: 4

Chiral Centers: 1

N+O: 5

LIPINSKY: 4

Info: Essential amino acid for human development

IUPAC: histidine

Smiles: c1c(C[C@H](C(O)=O)N)nc[nH]1

Specification: Amino Acid Derivatives; Histidine [His, H]; Amino Acids and Derivatives; alpha-Amino Acids; Amino Acids; Biochemistry; Amino Acids D-Histidine Chemical Properties:

mp 280-290 C (dec.) alpha -12

Chemical Compounds - Natural 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