| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 28 | Yes |
Popular Name: 6-(4-methylpiperazin-1-yl)-1-(3-phenylpropyl)-5H-imidazo[5,4-e][1,3]diazepine-4,8-dione 6-(4-methylpiperazin-1-yl)-1-(3-…
None
| 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) | 2.07 | 10.47 | -56.21 | 2 | 8 | 1 | 88 | 381.46 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.07 | 10.92 | -96.04 | 3 | 8 | 2 | 90 | 382.468 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.07 | 7.99 | -16.18 | 1 | 8 | 0 | 87 | 380.452 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.07 | 9.9 | -42.16 | 2 | 8 | 1 | 88 | 381.46 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![1,5-dihydroimidazo[4,5-e][1,3]diazepine-4,8-quinone](http://zinc12.docking.org/img/rings/22438.gif)
![1-(3-phenylpropyl)-6-piperazino-5H-imidazo[4,5-e][1,3]diazepine-4,8-quinone](http://zinc12.docking.org/img/rings/22437.gif)