| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 13th, 2014 | 14 | Yes |
Popular Name: Vinyl-L-NIO(hydrochloride) Vinyl-L-NIO(hydrochloride)
Find On: PubMed — Wikipedia — Google
CAS Number: 728944-69-2
| 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) | -3.07 | 1.89 | -42.19 | 6 | 5 | 0 | 106 | 199.254 | 7 | ↓ |
| Mid Mid (pH 6-8) | -3.07 | 1.9 | -42.35 | 6 | 5 | 0 | 106 | 199.254 | 7 | ↓ |
| Lo Low (pH 4.5-6) | -3.07 | 1.67 | -82.66 | 7 | 5 | 1 | 107 | 200.262 | 7 | ↓ |
| Lo Low (pH 4.5-6) | -3.07 | 1.67 | -83.72 | 7 | 5 | 1 | 107 | 200.262 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.