| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2010 | 21 | Yes |
Popular Name: (1S)-3-[(2S,5S)-2,5-dimethylmorpholin-4-yl]-1-phenyl-N-propyl-propan-1-amine (1S)-3-[(2S,5S)-2,5-dimethylmorp…
| 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) | 2.50 | 6.11 | -2.72 | 1 | 3 | 0 | 24 | 290.451 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.50 | 7.06 | -40.9 | 2 | 3 | 1 | 29 | 291.459 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.50 | 8.29 | -37.91 | 2 | 3 | 1 | 26 | 291.459 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.50 | 9.23 | -116.82 | 3 | 3 | 2 | 30 | 292.467 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
