L-Histidine Details
: IUPAC Name
L-Histidine
:Chemical Class
:CAS Registry Number
4104-45-4
:Description
:Fragrance Type
no aroma
Physical and Chemical properties
PUBCHEM ID | 6274 |
Molecular Weight (mg/mol) | 155.159 |
Molecular Formula | C4H11NS |
Hydrogen Bond Donor Count | 3 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 3 |
IUPAC Name | L-Histidine |
Canonical SMILES | CSCCCN |
PUBCHEM IUPAC INCHIKEY | KKYSBGWCYXYOHA-UHFFFAOYSA-N |
Solubility Level | 5 |
Vapour Pressure | -0.535 |
Absorption and Metabolism information
XLOGP3 AA | NA |
CACTVS TPSA | 100.61 |
BBB Level | 4 |
Absorption Level | 1 |
EXT PPB#Prediction | 0 |
AlogP98 | -1.234 |
EXT CYP2D6#Prediction | 0 |
Toxicological Information
Mouse Female FDA | Non-Carcinogen |
Mouse Male FDA | Single-Carcinogen |
Rat Female FDA | Single-Carcinogen |
Rat Male FDA | Non-Carcinogen |
Ames Prediction | Non-Mutagen |
Developmental / Reproductive Toxicity | Toxic |
Rat Oral LD50 | 0.471777 |
Ocular Irritancy | Severe |
Hepatotoxic#Prediction | 0 |
Effected Human Genes | NA |
Ecological Information
Aerobic Biodegradability Prediction | Non-Degradable |
Hazard(s) Identification
Physical hazards | not classified |
Health hazards | None |
Environmental hazards | not classified |
About Table Headings
Compound Biological Activity
Serial No. | Cas No | Gene Symbol | Organism | Interaction |
Interaction Actions | PubMed Id |
---|
1 |
4104-45-4 |
NA |
NA |
NA |
NA |
NA |
Serial No. | Activity Name | Details | References (PubMed) | Other details EPA (U.S) | Clinical Trials (U.S. NIH) |
---|
1 | | |
|
4104-45-4 |
L-Histidine |