| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2011 | 16 | Yes |
Popular Name: (2R)-1-[1-[(1-methylpyrazol-4-yl)methyl]imidazol-2-yl]propan-2-amine (2R)-1-[1-[(1-methylpyrazol-4-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) | -0.54 | 3.99 | -50.97 | 3 | 5 | 1 | 63 | 220.3 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.54 | 3.75 | -10.6 | 2 | 5 | 0 | 62 | 219.292 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.54 | 4.12 | -102.8 | 4 | 5 | 2 | 65 | 221.308 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
