| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 20 | Yes |
Popular Name: N-[(1R,2R)-2-imidazol-1-ylcyclopentyl]-1-propyl-piperidin-4-amine N-[(1R,2R)-2-imidazol-1-ylcyclop…
| 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) | 1.96 | 9.38 | -78.48 | 3 | 4 | 2 | 36 | 278.444 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.96 | 8.64 | -37.95 | 2 | 4 | 1 | 34 | 277.436 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.96 | 10.55 | -185.54 | 4 | 4 | 3 | 40 | 279.452 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.96 | 8.32 | -101.71 | 3 | 4 | 2 | 39 | 278.444 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
