| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 28th, 2011 | 19 | Yes |
Popular Name: 2-[(3-thienylmethylamino)methyl]-3H-quinazolin-4-one 2-[(3-thienylmethylamino)methyl]…
| 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) | 1.64 | 4.51 | -10.39 | 2 | 4 | 0 | 58 | 271.345 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.64 | 5.86 | -55.83 | 3 | 4 | 1 | 62 | 272.353 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2-[(3-thenylamino)methyl]-3H-quinazolin-4-one](http://zinc12.docking.org/img/rings/179558.gif)