| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2010 | 16 | No |
Popular Name: (3S)-N-[2-[4-(aminomethyl)triazol-1-yl]ethyl]-N-methyl-tetrahydrothiophen-3-amine (3S)-N-[2-[4-(aminomethyl)triazo…
| 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) | -0.05 | 3.36 | -106.65 | 4 | 5 | 2 | 63 | 243.38 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.05 | 1.1 | -49.47 | 3 | 5 | 1 | 62 | 242.372 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![Tetrahydrothiophen-3-yl-[2-(triazol-1-yl)ethyl]amine](http://zinc12.docking.org/img/rings/237221.gif)