| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2010 | 23 | Yes |
Popular Name: (2S)-N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-5-oxo-pyrrolidine-2-carboxamide (2S)-N-[4-(3,4-dihydro-1H-isoqui…
| 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) | 0.88 | 6.04 | -56.7 | 3 | 5 | 1 | 63 | 316.425 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.88 | 3.78 | -18.22 | 2 | 5 | 0 | 61 | 315.417 | 6 | ↓ |
![N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-5-keto-pyrrolidine-2-carboxamide](http://zinc12.docking.org/img/rings/548625.gif)
