| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 19th, 2009 | 21 | Yes |
Popular Name: 1-[(3S)-3-[(2S)-pyrrolidin-2-yl]-1-piperidyl]phthalazine 1-[(3S)-3-[(2S)-pyrrolidin-2-yl]…
| 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) | 2.50 | 8.57 | -79.54 | 3 | 4 | 2 | 47 | 284.407 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.50 | 8.58 | -79.76 | 3 | 4 | 2 | 47 | 284.407 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.50 | 8.42 | -43.29 | 2 | 4 | 1 | 46 | 283.399 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
