In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2008 | 16 | Yes |
Popular Name: [2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-4-pyridyl]methanamine [2-[(2S,6S)-2,6-dimethylmorpholi…
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 | 2.33 | -31.19 | 3 | 4 | 1 | 53 | 222.312 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.85 | 2.05 | -5.72 | 2 | 4 | 0 | 51 | 221.304 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.85 | 2.43 | -53.57 | 3 | 4 | 1 | 53 | 222.312 | 2 | ↓ |