| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 15 | Yes |
Popular Name: (3S,4R)-3-(2-propylimidazol-1-yl)tetrahydropyran-4-amine (3S,4R)-3-(2-propylimidazol-1-yl…
| 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) | 0.12 | 3.9 | -102.3 | 4 | 4 | 2 | 56 | 211.309 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.12 | 2.88 | -6.54 | 2 | 4 | 0 | 53 | 209.293 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.12 | 3.42 | -48.88 | 3 | 4 | 1 | 55 | 210.301 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
