| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 3rd, 2010 | 23 | Yes |
Popular Name: (4S)-4-(1,3-benzodioxol-4-yl)-3,4-dihydro-[1,3,5]triazino[1,2-a]benzimidazol-2-amine (4S)-4-(1,3-benzodioxol-4-yl)-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) | 2.42 | 8.81 | -36.45 | 4 | 7 | 1 | 86 | 308.321 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.29 | 7.48 | -19.01 | 3 | 7 | 0 | 87 | 307.313 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.29 | 7.99 | -40.9 | 4 | 7 | 1 | 88 | 308.321 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3,4-dihydro-1H-[1,3,5]triazino[1,2-a]benzimidazol-2-ylideneamine](http://zinc12.docking.org/img/rings/106203.gif)
![[4-(1,3-benzodioxol-4-yl)-3,4-dihydro-1H-[1,3,5]triazino[1,2-a]benzimidazol-2-ylidene]amine](http://zinc12.docking.org/img/rings/124040.gif)