| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 21st, 2011 | 19 | Yes |
Popular Name: (2S)-2-cyclopropyl-2-(methylamino)-3-[methyl-[(3R)-1-methyl-3-piperidyl]amino]propanoic (2S)-2-cyclopropyl-2-(methylamin…
| 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) | -1.26 | 5.65 | -63.5 | 3 | 5 | 1 | 64 | 270.397 | 6 | ↓ |
| Hi High (pH 8-9.5) | -1.26 | 4.28 | -30.73 | 2 | 5 | 0 | 60 | 269.389 | 6 | ↓ |
| Mid Mid (pH 6-8) | -1.26 | 5.94 | -71.52 | 3 | 5 | 1 | 64 | 270.397 | 6 | ↓ |
| Lo Low (pH 4.5-6) | -1.26 | 7.87 | -144.85 | 4 | 5 | 2 | 66 | 271.405 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
