| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 23rd, 2008 | 26 | Yes |
Popular Name: 6-[(4-ethoxyphenyl)methyl]-3-(2-morpholinoethylamino)-4H-1,2,4-triazin-5-one 6-[(4-ethoxyphenyl)methyl]-3-(2-…
| 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) | 1.83 | 3.64 | -18.54 | 2 | 8 | 0 | 92 | 359.43 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.29 | 3.53 | -42.33 | 1 | 8 | -1 | 95 | 358.422 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.83 | 5.96 | -66.99 | 3 | 8 | 1 | 94 | 360.438 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.29 | 4.73 | -58.4 | 2 | 8 | 0 | 97 | 359.43 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
