| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2011 | 18 | Yes |
Popular Name: N-[(4-chloro-3-fluoro-phenyl)methyl]-1-[(2S)-4-methylmorpholin-2-yl]methanamine N-[(4-chloro-3-fluoro-phenyl)met…
| 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) | 2.13 | 4.4 | -48.52 | 2 | 3 | 1 | 29 | 273.759 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.13 | 2.98 | -5.85 | 1 | 3 | 0 | 24 | 272.751 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.13 | 5.4 | -40.61 | 2 | 3 | 1 | 26 | 273.759 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.13 | 6.82 | -112.73 | 3 | 3 | 2 | 30 | 274.767 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
