In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 4th, 2009 | 29 | Yes |
Popular Name: (E,2S,3R,4R,5R)-2-amino-3,4,5-trihydroxy-2-(hydroxymethyl)-14-oxo-icos-6-enoic (E,2S,3R,4R,5R)-2-amino-3,4,5-tr…
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) | 0.14 | 2.16 | -42.42 | 7 | 8 | 0 | 166 | 417.543 | 18 | ↓ |
Hi High (pH 8-9.5) | 0.14 | 1.77 | -54.13 | 6 | 8 | -1 | 164 | 416.535 | 18 | ↓ |