In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 5th, 2004 | 8 | Yes |
Popular Name: Creatinine Creatinine
Find On: PubMed — Wikipedia — Google
CAS Numbers: 143827-20-7 , 16045-72-0 , 19230-81-0 , 60-27-5 , [60-27-5]
1-methyl-2-amino-imidazol-4-one; 2-imino-1-methyl-4-imidazolidinone; 60-27-5; creatinine; krebiozen
1-Methylglycocyamidine; 60-27-5; C00791; Creatinine
2-Imino-1-methylimidazolidin-4-one
60-27-5; Creatinine (NF); D03600
CHEBI:3910; CHEBI:23406; CHEBI:14029
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | -1.15 | 0.33 | -14.7 | 2 | 4 | 0 | 59 | 113.12 | 0 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Mp [°C] | 255 | Acros Organics |
Purity | 95% | Fluorochem |
Melting_Point | ca 255? dec. | Alfa-Aesar |
Melting_Point | ca 255° dec. | Alfa-Aesar |
UniProt Database Links | CLD16_BOVIN; CRNA_PSEPU; CSH_ARTSP; LGMN_MOUSE; MFTE_MYCTU; S22A2_HUMAN; S22A2_MOUSE; S22A2_PIG; S22A2_PONAB; S22A2_RABIT; S22A2_RAT; S47A1_HUMAN; S47A1_MOUSE; S47A1_PONAB; S47A1_RAT; S47A2_HUMAN; S47A2_PONAB; S47A2_RABIT | ChEBI |
Patent Database Links | EP1422218; EP1627638; EP1645266; EP1685843; EP1785142; EP1870093; EP1886687; EP1905453; EP1911463; EP1917956; EP1932529; EP1941863; US2002137027; US2004132200; US2005154199; US2005187267; US2005272781; US2006128680; US2006135822; US2007185038; US200719005 | ChEBI |
Therapy | metabolic enhancer | SMDC Pharmakon |
Target | Others | Selleck Chemicals |
Reactome Database Links | REACT_20650; REACT_22283; REACT_22327; REACT_808 | ChEBI |
S phrase | S24/25: Avoid contact with skin and eyes. | Acros Organics |
Description | Species |
---|---|
Creatine metabolism | |
Organic cation transport | |
Transport of glucose and other sugars, bile salts and organic acids, metal ions |
No pre-computed analogs available. Try a structural similarity search.