| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 19th, 2011 | 21 | Yes |
Popular Name: methyl 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) | 1.17 | 7.33 | -84.57 | 3 | 5 | 2 | 51 | 297.443 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.17 | 4.34 | -4.48 | 1 | 5 | 0 | 45 | 295.427 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.17 | 6.77 | -44.54 | 2 | 5 | 1 | 46 | 296.435 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.17 | 5.91 | -32.85 | 2 | 5 | 1 | 46 | 296.435 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.17 | 9.26 | -203.01 | 4 | 5 | 3 | 52 | 298.451 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2,3,4,5,7,8,9,9a-octahydro-1H-pyrrolo[1,2-a][1,4]diazepine](http://zinc12.docking.org/img/rings/22747.gif)
![3-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl)propyl-cyclopropyl-amine](http://zinc12.docking.org/img/rings/312876.gif)