| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 16th, 2010 | 17 | Yes |
Popular Name: 1-(2,5-dichloro-3-thienyl)-2-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]ethanone 1-(2,5-dichloro-3-thienyl)-2-[(2…
| 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) | 2.44 | 4.71 | -36.94 | 2 | 3 | 1 | 42 | 295.211 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.44 | 2.91 | -7.17 | 1 | 3 | 0 | 41 | 294.203 | 4 | ↓ |
