In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 19th, 2011 | 17 | Yes |
Popular Name: (2R)-N-methyl-1-[(3S,6R)-6-methyl-3-piperidyl]piperidine-2-carboxamide (2R)-N-methyl-1-[(3S,6R)-6-methy…
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) | 0.85 | 2.28 | -32.07 | 3 | 4 | 1 | 46 | 240.371 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.85 | 1.52 | -37.11 | 3 | 4 | 1 | 49 | 240.371 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.85 | 0.26 | -7.25 | 2 | 4 | 0 | 44 | 239.363 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.85 | 3.54 | -99.21 | 4 | 4 | 2 | 50 | 241.379 | 2 | ↓ |