In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 4th, 2006 | 14 | No |
Popular Name: ISOPENTENYL PYROPHOSPHATE ISOPENTENYL PYROPHOSPHATE
Find On: PubMed — Wikipedia — Google
CAS Numbers: 116057-53-5 , 1186-30-7 , 358-71-4
3-methylbut-3-enyl pyrophosphate
CHEBI:14473; CHEBI:6037; CHEBI:24907
gamma, gamma-Dimethylallyl Diphosphate-TA
gamma, gamma-DIMETHYLALLYL DIPHOSPHATE-TA; [1186-30-7]
Isopentenylpyrophosphatetriammoniumsaltsolution
[hydroxy(3-methylbut-3-en-1-yl)oxyphosphoryl]oxyphosphonic acid
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) | -0.53 | 2.65 | -236.75 | 0 | 7 | -3 | 122 | 243.068 | 6 | ↓ |
Mid Mid (pH 6-8) | -0.53 | 1.49 | -118.99 | 1 | 7 | -2 | 119 | 244.076 | 6 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
ALOGPS_SOLUBILITY | 6.69e+00 g/l | DrugBank-experimental |
UniProt Database Links | CHRDS_ARTSI; COQ1_NEUCR; COQ1_YARLI; COQ1_YEAST; CRIT_STRCO; CRTE_CYAPA; CRTE_ESCVU; CRTE_PANAN; CRTE_RHOCB; CRTE_RHOS4; DDPS1_ARATH; DPDP_THEFY; DPDS_MYCBO; DPDS_MYCLE; DPDS_MYCS2; DPDS_MYCTU; DPS1_DICDI; DPS1_HUMAN; DPS1_MOUSE; DPS1_SCHPO; DXR1_BACAN; D | ChEBI |
Patent Database Links | EP1947189; US2003190734; US2004176570; US2007026076; US2007254354 | ChEBI |
Reactome Database Links | REACT_160269; REACT_172644; REACT_9451; REACT_9467; REACT_9488; REACT_9517 | ChEBI |