| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2004 | 17 | No |
Popular Name: 1- PROPAN-1-ONE 1- PROPAN-1-ONE
Find On: PubMed — Wikipedia — Google
CAS Number: 288401-30-9
| 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) | 3.45 | 8.51 | -55.6 | 0 | 5 | -1 | 86 | 236.247 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.45 | 7.41 | -13.15 | 1 | 5 | 0 | 83 | 237.255 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.