| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2011 | 25 | Yes |
Popular Name: 3-ethyl-7-[(3S)-3-(methoxymethyl)piperidine-1-carbonyl]-1H-quinazoline-2,4-dione 3-ethyl-7-[(3S)-3-(methoxymethyl…
| 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) | 0.77 | 5.61 | -14.11 | 1 | 7 | 0 | 84 | 345.399 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.23 | 3.73 | -40.72 | 0 | 7 | -1 | 87 | 344.391 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
