| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 17th, 2010 | 18 | Yes |
Popular Name: (1S)-1-(5-ethyl-2-thienyl)-N-[(1S)-1-(3-pyridyl)ethyl]ethanamine (1S)-1-(5-ethyl-2-thienyl)-N-[(1…
| 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) | 3.47 | 8.33 | -38.01 | 2 | 2 | 1 | 29 | 261.414 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.47 | 7.37 | -5.23 | 1 | 2 | 0 | 25 | 260.406 | 5 | ↓ |
