| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2010 | 18 | Yes |
Popular Name: (1S)-N-methyl-3-[(2S)-2-methylmorpholin-4-yl]-1-phenyl-propan-1-amine (1S)-N-methyl-3-[(2S)-2-methylmo…
| 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) | 1.29 | 3.88 | -3.1 | 1 | 3 | 0 | 24 | 248.37 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.29 | 5.01 | -41.52 | 2 | 3 | 1 | 29 | 249.378 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.29 | 6.16 | -35.28 | 2 | 3 | 1 | 26 | 249.378 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.29 | 7.3 | -116.97 | 3 | 3 | 2 | 30 | 250.386 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
