| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2011 | 21 | Yes |
Popular Name: 1-chloro-4-[(3R)-3-pyrrolidin-1-ylpyrrolidin-1-yl]phthalazine 1-chloro-4-[(3R)-3-pyrrolidin-1-…
| 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) | 3.31 | 9.09 | -52.45 | 1 | 4 | 1 | 33 | 303.817 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.31 | 6.71 | -9.89 | 0 | 4 | 0 | 32 | 302.809 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 3.31 | 9.92 | -85.09 | 2 | 4 | 2 | 35 | 304.825 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 3.31 | 9.23 | -84.14 | 2 | 4 | 2 | 35 | 304.825 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
