| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2010 | 19 | Yes |
Popular Name: 3-[5-[[1-ethylpropyl(2-hydroxyethyl)amino]methyl]-3-thienyl]prop-2-yn-1-ol 3-[5-[[1-ethylpropyl(2-hydroxyet…
| 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) | 2.25 | 3.7 | -35.17 | 3 | 3 | 1 | 45 | 282.429 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.25 | 2.41 | -8.81 | 2 | 3 | 0 | 44 | 281.421 | 7 | ↓ |
