In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 7th, 2010 | 18 | Yes |
Popular Name: 6-[2-(4-methyl-1-piperidyl)ethylamino]-2H-1,2,4-triazine-3,5-dione 6-[2-(4-methyl-1-piperidyl)ethyl…
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) | -0.05 | 1.83 | -44.57 | 4 | 7 | 1 | 95 | 254.314 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.41 | 0.17 | -51.74 | 3 | 7 | 0 | 98 | 253.306 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.