| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2011 | 21 | Yes |
Popular Name: (2S)-2-[(3S)-3-morpholinopyrrolidin-1-yl]-3-phenyl-propan-1-amine (2S)-2-[(3S)-3-morpholinopyrroli…
| 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) | 0.93 | 2.71 | -48.05 | 3 | 4 | 1 | 43 | 290.431 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.93 | 3.81 | -33.63 | 3 | 4 | 1 | 43 | 290.431 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.93 | 2.64 | -3.79 | 2 | 4 | 0 | 42 | 289.423 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.93 | 4.16 | -130.27 | 4 | 4 | 2 | 45 | 291.439 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.93 | 4.94 | -117.39 | 4 | 4 | 2 | 45 | 291.439 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
