| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 8th, 2011 | 19 | Yes |
Popular Name: 2-methyl-2-(methylamino)-1-[(3S)-3-(4-methyl-1,2,4-triazol-3-yl)-1-piperidyl]propan-1-one 2-methyl-2-(methylamino)-1-[(3S)…
| 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) | -0.12 | 5.92 | -46.24 | 2 | 6 | 1 | 68 | 266.369 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.12 | 5.99 | -13.22 | 1 | 6 | 0 | 63 | 265.361 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
