| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2011 | 20 | Yes |
Popular Name: 1-[(2S)-4-methylmorpholin-2-yl]-N-[[2-(trifluoromethyl)phenyl]methyl]methanamine 1-[(2S)-4-methylmorpholin-2-yl]-…
| 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) | 2.21 | 3.88 | -6.04 | 1 | 3 | 0 | 24 | 288.313 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.21 | 6.3 | -38.18 | 2 | 3 | 1 | 26 | 289.321 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.21 | 4.89 | -40.24 | 2 | 3 | 1 | 29 | 289.321 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.21 | 7.31 | -104.45 | 3 | 3 | 2 | 30 | 290.329 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
