| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 16 | No |
Popular Name: N-[2-[(3S)-3-methylthiomorpholin-4-yl]ethyl]tetrahydropyran-4-amine N-[2-[(3S)-3-methylthiomorpholin…
| 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) | 1.22 | 3.59 | -44.71 | 2 | 3 | 1 | 29 | 245.412 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.22 | 2.41 | -3.4 | 1 | 3 | 0 | 24 | 244.404 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.22 | 5.61 | -122.93 | 3 | 3 | 2 | 30 | 246.42 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
