| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 16 | No |
Popular Name: (3Z)-3-(aminomethylene)-1,2-dihydropyrrolo[2,1-b]quinazolin-9-one (3Z)-3-(aminomethylene)-1,2-dihy…
| 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) | 0.88 | 4.45 | -11.52 | 1 | 4 | 0 | 59 | 213.24 | 1 | ↓ |
| Mid Mid (pH 6-8) | 0.88 | 4.46 | -12.11 | 1 | 4 | 0 | 59 | 213.24 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 0.88 | 4.4 | -28.06 | 2 | 4 | 0 | 60 | 214.248 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-9-one](http://zinc12.docking.org/img/rings/7115.gif)