In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 18 | Yes |
Popular Name: [5-[(2S,5R)-5-ethyl-2-methyl-morpholin-4-yl]-1,3-dimethyl-pyrazol-4-yl]methanamine [5-[(2S,5R)-5-ethyl-2-methyl-mor…
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) | 1.02 | 3.3 | -47.66 | 3 | 5 | 1 | 58 | 253.37 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.02 | 2.91 | -5.08 | 2 | 5 | 0 | 56 | 252.362 | 3 | ↓ |