Bioactive Compound Details

BioIDbio3049
NameHISTIDINE
ChEMBL IDCHEMBL17962
Molecular FormulaC6H9N3O2
Molecular Weight155.16
Molecular Weight (Monoisotopic)155.0695
TypeSmall molecule
Max PhasePhase 2
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
SynonymsFEMA NO. 3694|HISTIDINA|HISTIDINE|L-HISTIDINE|NSC-137773
SmilesN[C@@H](Cc1c[nH]cn1)C(=O)O
InchiInChI=1S/C6H9N3O2/c7-5(6(10)11)1-4-2-8-3-9-4/h2-3,5H,1,7H2,(H,8,9)(H,10,11)/t5-/m0/s1
Inchi KeyHNDVDQJCIGZPNO-YFKPBYRVSA-N
Molecular SpeciesZWITTERION
Targets41.0
Bioactivities138.0
Np Likeness Score0.45
Records Key['Histidine', 'L-histidine', '46', 'Histidine', 'L-His', '10', 'L-His', 'histidine', '2-Amino-3-(1H-imidazol-4-yl)-propionic acid', '1', '1', 'SID11111281', '1', '1, L-His', 'histidine', '1', '1, L-His', '1', 'L-His', '1', 'Histidine', 'L-histidine', '11', 'L-Histidine', '1', '1', 'SID90340851', '1, L-His', 'Histidine', 'Histidine', 'HISTIDINE', '53', '3', '1', 'HISTIDINE', '1, L-His', '15; L-His', '1', '1', '1', '1; L-His', 'His', 'BDBM181118', 'BDBM181118', '1', '6']
Records Name['(S)-2-Amino-3-(1H-imidazol-4-yl)-propionic acid', '2-ammonio-3-(1H-imidazol-5-yl)propanoate', '2-Amino-3-(3H-imidazol-4-yl)-propionic acid', '2-Amino-3-(1H-imidazol-4-yl)-propionic acid', '(S)-2-Amino-3-(3H-imidazol-4-yl)-propionic acid', '2-Amino-3-(1H-imidazol-4-yl)-propionic acid', 'L-histidine', '2-Amino-3-(1H-imidazol-4-yl)-propionic acid', '2-Amino-3-(1H-imidazol-4-yl)-propionic acid', '(S)-2-amino-3-(1H-imidazol-4-yl)propanoic acid', 'L-his', 'SID11111281', 'L-His', '(S)-2-amino-3-(1H-imidazol-4-yl)propanoic acid', '(S)-2-amino-3-(1H-imidazol-4-yl)propanoic acid', 'L-His', '(S)-2-amino-3-(1H-imidazol-4-yl)propanoic acid', '(S)-2-amino-3-(1H-imidazol-5-yl)propanoic acid', 'L-histidine', 'L-His', '2-Amino-3-(1H-imidazol-4-yl)-propionic acid (Histidine)', 'L-histidine', '2-amino-3-(1H-imidazol-4-yl)propanoic acid', 'L-Histidine', 'L-Histidine', 'L-Histidine', 'SID90340851', 'L-Histamine', 'Histidine', 'Histidine', 'HISTIDINE', '(S)-2-amino-3-(1H-imidazol-4-yl)propanoic acid', 'L-histidine', 'L-Histidine', 'HISTIDINE', '(S)-2-amino-3-(1H-imidazol-5-yl)propanoic acid', 'L-Histidine', 'L-His', 'L-His', '(S)-2-amino-3-(1H-imidazol-4-yl)propanoic acid', '(S)-2-amino-3-(1H-imidazol-5-yl)propanoic acid', 'Histidine', 'US9138393, Histidine::US9144538, Histidine', 'US9138393, Histidine::US9144538, Histidine', '(S)-2-amino-3-(1H-imidazol-5-yl)propanoic acid', 'L-Histidine']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure