In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 19th, 2011 | 15 | Yes |
Popular Name: 2,2-dimethyl-4-[(3R,6S)-6-methyl-3-piperidyl]morpholine 2,2-dimethyl-4-[(3R,6S)-6-methyl…
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) | 1.50 | 2.51 | -38.15 | 2 | 3 | 1 | 29 | 213.345 | 1 | ↓ |
Hi High (pH 8-9.5) | 1.50 | 1.27 | -1.85 | 1 | 3 | 0 | 24 | 212.337 | 1 | ↓ |
Lo Low (pH 4.5-6) | 1.50 | 3.38 | -31.71 | 2 | 3 | 1 | 26 | 213.345 | 1 | ↓ |
Lo Low (pH 4.5-6) | 1.50 | 4.64 | -107.9 | 3 | 3 | 2 | 30 | 214.353 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.