In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 11th, 2011 | 22 | Yes |
Popular Name: (2S)-1-[2-(3-chloropyridazin-4-yl)phenoxy]-3-(isopropylamino)propan-2-ol (2S)-1-[2-(3-chloropyridazin-4-y…
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) | 2.56 | 4.4 | -44.83 | 3 | 5 | 1 | 72 | 322.816 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.56 | 3.24 | -11.48 | 2 | 5 | 0 | 67 | 321.808 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.