| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2009 | 20 | Yes |
Popular Name: N-[(1S,2S)-2-imidazol-1-ylcyclopentyl]-1-prop-2-ynyl-piperidin-4-amine N-[(1S,2S)-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) | 1.24 | 7.33 | -49.57 | 2 | 4 | 1 | 38 | 273.404 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.24 | 6.22 | -7.01 | 1 | 4 | 0 | 33 | 272.396 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.24 | 8.07 | -103.27 | 3 | 4 | 2 | 39 | 274.412 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
