| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 22nd, 2008 | 17 | Yes |
Popular Name: 5-[(4-dimethylaminophenyl)amino]-2H-1,2,4-triazin-3-one 5-[(4-dimethylaminophenyl)amino]…
| 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) | 1.15 | 2.65 | -16.58 | 2 | 6 | 0 | 74 | 231.259 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.60 | 0.99 | -54.51 | 1 | 6 | -1 | 77 | 230.251 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.15 | 3.41 | -51.78 | 3 | 6 | 0 | 75 | 232.267 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
