| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2011 | 15 | Yes |
Popular Name: (3R,4S)-4-methyl-1-(tetrahydropyran-4-ylmethyl)piperidin-3-amine (3R,4S)-4-methyl-1-(tetrahydropy…
| 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) | 0.84 | 4.15 | -116.56 | 4 | 3 | 2 | 41 | 214.353 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.84 | 2.21 | -42.38 | 3 | 3 | 1 | 40 | 213.345 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.84 | 3.86 | -35.47 | 3 | 3 | 1 | 40 | 213.345 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
