In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 19 | Yes |
Popular Name: [(1R,2R,4S)-4-ethyl-2-[(2S,5S)-5-ethyl-2-methyl-morpholin-4-yl]cyclohexyl]methanamine [(1R,2R,4S)-4-ethyl-2-[(2S,5S)-5…
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) | 2.68 | 4.33 | -47.94 | 3 | 3 | 1 | 40 | 269.453 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.68 | 5.45 | -108.57 | 4 | 3 | 2 | 41 | 270.461 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.