| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 4th, 2010 | 20 | Yes |
Popular Name: (2S)-1-(5-chloro-2-thienyl)-2-[2-dimethylaminoethyl(isobutyl)amino]propan-1-one (2S)-1-(5-chloro-2-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) | 3.67 | 8.58 | -43.57 | 1 | 3 | 1 | 25 | 317.906 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.67 | 6.11 | -3.84 | 0 | 3 | 0 | 24 | 316.898 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.67 | 8.05 | -33.86 | 1 | 3 | 1 | 25 | 317.906 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.67 | 10.53 | -112.89 | 2 | 3 | 2 | 26 | 318.914 | 8 | ↓ |
