| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 19th, 2011 | 24 | Yes |
Popular Name: N'-(4-bromo-5-methyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-4-methylbenzohydrazide N'-(4-bromo-5-methyl-2-oxo-1,2-d…
| 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) | 1.94 | 1.16 | -52.59 | 4 | 5 | 1 | 69 | 334.484 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.94 | 2.42 | -42.91 | 4 | 5 | 1 | 66 | 334.484 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.94 | -0.28 | -8.32 | 3 | 5 | 0 | 65 | 333.476 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.94 | 3.86 | -118.79 | 5 | 5 | 2 | 70 | 335.492 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![1,2,3,3a,4,5,6,6a-octahydropyrrolo[3,4-c]pyrrole](http://zinc12.docking.org/img/rings/186766.gif)
![N-(2-adamantylmethyl)-2,3,3a,4,5,6-hexahydro-1H-pyrrolo[3,4-c]pyrrole-6a-carboxamide](http://zinc12.docking.org/img/rings/420568.gif)