| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2011 | 16 | Yes |
Popular Name: 6-[(3R,4S)-3-amino-4-methyl-1-piperidyl]-2H-1,2,4-triazine-3,5-dione 6-[(3R,4S)-3-amino-4-methyl-1-pi…
| 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) | -1.25 | -1.34 | -47.17 | 5 | 7 | 1 | 109 | 226.26 | 1 | ↓ |
| Mid Mid (pH 6-8) | -0.79 | -3.03 | -60.58 | 4 | 7 | 0 | 113 | 225.252 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
