| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2010 | 20 | No |
Popular Name: (2S)-1-[[(1R)-1-(2-fluorophenyl)ethyl]amino]-3-(1,2,5-thiadiazol-3-yloxy)propan-2-ol (2S)-1-[[(1R)-1-(2-fluorophenyl)…
| 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) | 1.92 | 0.99 | -45.04 | 3 | 5 | 1 | 72 | 298.363 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.92 | 0.01 | -6.22 | 2 | 5 | 0 | 67 | 297.355 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![Benzyl-[3-(1,2,5-thiadiazol-3-yloxy)propyl]amine](http://zinc12.docking.org/img/rings/36321.gif)