| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 6th, 2014 | 19 | Yes |
Popular Name: BOC-9-AMINONONANOIC ACID BOC-9-AMINONONANOIC ACID
Find On: PubMed — Wikipedia — Google
CAS Number: 173435-78-4
| 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) | 2.54 | 7.77 | -74.04 | 3 | 5 | 0 | 94 | 273.373 | 11 | ↓ |
| Mid Mid (pH 6-8) | 2.54 | 7.43 | -46.71 | 2 | 5 | -1 | 92 | 272.365 | 11 | ↓ |
| Lo Low (pH 4.5-6) | 2.54 | 5.79 | -46.71 | 4 | 5 | 1 | 91 | 274.381 | 11 | ↓ |
No pre-computed analogs available. Try a structural similarity search.