| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 25th, 2010 | 21 | Yes |
Popular Name: 2-[[[(1R)-2-imidazol-1-yl-1-methyl-ethyl]amino]methyl]-3H-quinazolin-4-one 2-[[[(1R)-2-imidazol-1-yl-1-meth…
| 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) | 0.66 | 6.44 | -38.74 | 3 | 6 | 1 | 77 | 284.343 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.12 | 3.36 | -50.63 | 1 | 6 | -1 | 79 | 282.327 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.66 | 5.92 | -14.74 | 2 | 6 | 0 | 76 | 283.335 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.12 | 4.26 | -51.47 | 2 | 6 | 0 | 83 | 283.335 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.66 | 7.35 | -120.25 | 4 | 6 | 2 | 81 | 285.351 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2-[(2-imidazol-1-ylethylamino)methyl]-3H-quinazolin-4-one](http://zinc12.docking.org/img/rings/544556.gif)