| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 23rd, 2006 | 24 | Yes |
Popular Name: 6-[(4-methoxyphenyl)methyl]-3-(3-pyridylmethylamino)-4H-1,2,4-triazin-5-one 6-[(4-methoxyphenyl)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) | 1.74 | 4.4 | -25.48 | 2 | 7 | 0 | 93 | 323.356 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.20 | 4.29 | -44.06 | 1 | 7 | -1 | 96 | 322.348 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.74 | 4.84 | -64.22 | 3 | 7 | 1 | 94 | 324.364 | 6 | ↓ |
