| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 16th, 2008 | 28 | No |
Popular Name: Inositol 1,3,4,5-tetraphosphate Inositol 1,3,4,5-tetraphosphate
Find On: PubMed — Wikipedia — Google
CAS Numbers: 102850-29-3 , 135269-51-1 , 210488-61-2
D-myo-Inositol-1,3,4,5-tetrakisphosphate,octapotassiumsalt
D-myo-Inositol-1,3,4,5-tetraphosphate (sodium salt)
[(1R,2S,4S,5S)-2,4-dihydroxy-3,5,6-tris(phosphonooxy)cyclohexyl]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) | -5.07 | -9.42 | -452.62 | 5 | 18 | -5 | 322 | 495.032 | 8 | ↓ |
| Mid Mid (pH 6-8) | -5.07 | -7.13 | -783.43 | 3 | 18 | -7 | 327 | 493.016 | 8 | ↓ |
| Mid Mid (pH 6-8) | -5.07 | -7.13 | -847.56 | 3 | 18 | -7 | 327 | 493.016 | 8 | ↓ |
| Mid Mid (pH 6-8) | -5.07 | -5.98 | -1017.37 | 2 | 18 | -8 | 330 | 492.008 | 8 | ↓ |
| Mid Mid (pH 6-8) | -5.07 | -7.13 | -802.56 | 3 | 18 | -7 | 327 | 493.016 | 8 | ↓ |
| Lo Low (pH 4.5-6) | -5.07 | -10.56 | -296.24 | 6 | 18 | -4 | 319 | 496.04 | 8 | ↓ |
