| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2011 | 18 | Yes |
Popular Name: 2-[1-[[1-[(1S)-1-methylpropyl]pyrazol-3-yl]methyl]imidazol-2-yl]ethanamine 2-[1-[[1-[(1S)-1-methylpropyl]py…
| 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) | 0.61 | 5.32 | -48.16 | 3 | 5 | 1 | 63 | 248.354 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.61 | 4.93 | -10.34 | 2 | 5 | 0 | 62 | 247.346 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.61 | 5.71 | -105.72 | 4 | 5 | 2 | 65 | 249.362 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
