| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 23rd, 2006 | 25 | Yes |
Popular Name: 6-[(4-ethoxyphenyl)methyl]-3-(3-pyridylmethylamino)-4H-1,2,4-triazin-5-one 6-[(4-ethoxyphenyl)methyl]-3-(3-…
| 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) | 2.57 | 5.21 | -43.42 | 1 | 7 | -1 | 96 | 336.375 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.12 | 6.68 | -14.49 | 2 | 7 | 0 | 93 | 337.383 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.12 | 7.14 | -49.01 | 3 | 7 | 1 | 94 | 338.391 | 7 | ↓ |
