| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2008 | 13 | Yes |
Popular Name: 2-[[(1R)-2-amino-1-(2-thienyl)ethyl]-methyl-amino]ethanol 2-[[(1R)-2-amino-1-(2-thienyl)et…
| 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) | 0.00 | -0.46 | -40.55 | 4 | 3 | 1 | 51 | 201.315 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.00 | -1.13 | -3.82 | 3 | 3 | 0 | 49 | 200.307 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.00 | 1.45 | -27.07 | 4 | 3 | 1 | 51 | 201.315 | 5 | ↓ |
