| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2011 | 21 | Yes |
Popular Name: (3S)-1-(4-chlorophthalazin-1-yl)-N,N-diethyl-pyrrolidin-3-amine (3S)-1-(4-chlorophthalazin-1-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) | 3.66 | 8.91 | -51.23 | 1 | 4 | 1 | 33 | 305.833 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.66 | 6.83 | -9.06 | 0 | 4 | 0 | 32 | 304.825 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.66 | 9.69 | -76.17 | 2 | 4 | 2 | 35 | 306.841 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.66 | 9.69 | -83.95 | 2 | 4 | 2 | 35 | 306.841 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
