| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 29th, 2008 | 25 | Yes |
Popular Name: (6E)-2-methoxy-6-[4-(1-piperidyl)-1H-quinazolin-2-ylidene]cyclohexa-2,4-dien-1-one (6E)-2-methoxy-6-[4-(1-piperidyl…
| 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) | 4.33 | 10.18 | -61.25 | 0 | 5 | -1 | 61 | 334.399 | 3 | ↓ |
| Mid Mid (pH 6-8) | 4.33 | 9.26 | -11.77 | 1 | 5 | 0 | 58 | 335.407 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 4.07 | 11.14 | -33.2 | 3 | 5 | 0 | 61 | 337.423 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 4.33 | 9.61 | -11.14 | 2 | 5 | 0 | 60 | 336.415 | 3 | ↓ |
