| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2010 | 16 | Yes |
Popular Name: 2-hydroxy-7-(morpholinomethyl)cyclohepta-2,4,6-trien-1-one 2-hydroxy-7-(morpholinomethyl)cy…
| 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) | 0.88 | 2.74 | -49.78 | 0 | 4 | -1 | 53 | 220.248 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.88 | 1.83 | -14.89 | 1 | 4 | 0 | 50 | 221.256 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.19 | 5.18 | -42.22 | 1 | 4 | 0 | 54 | 221.256 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.88 | 4.14 | -37.76 | 2 | 4 | 1 | 51 | 222.264 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
