In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 16th, 2011 | 21 | Yes |
Popular Name: (3S)-3-methyl-N-[1-[2-(methylamino)-2-oxo-ethyl]-4-piperidyl]piperidine-3-carboxamide (3S)-3-methyl-N-[1-[2-(methylami…
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) | 0.23 | 3.02 | -84.3 | 5 | 6 | 2 | 79 | 298.431 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.23 | 0.85 | -38.53 | 4 | 6 | 1 | 78 | 297.423 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.