| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 16 | No |
Popular Name: (2R)-2-[(3S)-3-methylthiomorpholin-4-yl]-2-(4-pyridyl)ethanamine (2R)-2-[(3S)-3-methylthiomorphol…
| 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) | 0.16 | 3.03 | -52.41 | 3 | 3 | 1 | 44 | 238.38 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.16 | 2.91 | -4.73 | 2 | 3 | 0 | 42 | 237.372 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
