In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 15th, 2011 | 17 | Yes |
Popular Name: (2S,5S)-5-ethyl-2-methyl-4-[(4-methyl-4-piperidyl)methyl]morpholine (2S,5S)-5-ethyl-2-methyl-4-[(4-m…
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) | 1.87 | 4.61 | -40.17 | 2 | 3 | 1 | 29 | 241.399 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.87 | 5.97 | -95.29 | 3 | 3 | 2 | 30 | 242.407 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.