| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2010 | 19 | Yes |
Popular Name: [1-[2-[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]ethyl]triazol-4-yl]methanamine [1-[2-[(4S)-4-methyl-6,7-dihydro…
| 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) | 1.13 | 4.71 | -105.75 | 4 | 5 | 2 | 63 | 279.413 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.13 | 2.66 | -51.11 | 3 | 5 | 1 | 62 | 278.405 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.13 | 2.26 | -9.85 | 2 | 5 | 0 | 60 | 277.397 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![4,5,6,7-tetrahydrothieno[3,2-c]pyridine](http://zinc12.docking.org/img/rings/1811.gif)
![5-[2-(triazol-1-yl)ethyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine](http://zinc12.docking.org/img/rings/228402.gif)