| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 15 | No |
Popular Name: [4-[(3S)-3-methylthiomorpholin-4-yl]tetrahydropyran-4-yl]methanamine [4-[(3S)-3-methylthiomorpholin-4…
| 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) | 0.31 | 1.18 | -47.82 | 3 | 3 | 1 | 40 | 231.385 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.31 | 0.85 | -3.53 | 2 | 3 | 0 | 38 | 230.377 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.31 | 2.86 | -123.41 | 4 | 3 | 2 | 41 | 232.393 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
