In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2011 | 26 | Yes |
Popular Name: (3-amino-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-6-yl)-(2-phenoxy-3-pyridyl)methanone (3-amino-7,8-dihydro-5H-pyrido[4…
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) | 1.61 | 5.35 | -43.03 | 3 | 7 | 1 | 95 | 348.386 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.61 | 5.23 | -22.03 | 2 | 7 | 0 | 94 | 347.378 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.61 | 5.4 | -45.63 | 3 | 7 | 1 | 95 | 348.386 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.