In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 29th, 2011 | 20 | Yes |
Popular Name: 1-isopropyl-3-[3-(6-oxo-1H-pyridazin-3-yl)phenyl]urea 1-isopropyl-3-[3-(6-oxo-1H-pyrid…
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) | 1.90 | 2.75 | -17.55 | 3 | 6 | 0 | 87 | 272.308 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.36 | 0.92 | -63.29 | 2 | 6 | -1 | 90 | 271.3 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.