| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 10th, 2011 | 15 | Yes |
Popular Name: (2R)-N-(3-thienylmethyl)-1-(1,2,4-triazol-1-yl)propan-2-amine (2R)-N-(3-thienylmethyl)-1-(1,2,…
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) | 0.56 | 7.32 | -42.55 | 2 | 4 | 1 | 47 | 223.325 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.56 | 5.94 | -7.98 | 1 | 4 | 0 | 43 | 222.317 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3-thenyl-[2-(1,2,4-triazol-1-yl)ethyl]amine](http://zinc12.docking.org/img/rings/537056.gif)