In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 11th, 2011 | 27 | Yes |
Popular Name: 5-[(3-ethyl-1H-pyrazol-5-yl)methyl]-3-(1-naphthyl)-6,7-dihydro-4H-isoxazolo[4,5-c]pyridine 5-[(3-ethyl-1H-pyrazol-5-yl)meth…
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) | 4.08 | 8.89 | -13.58 | 1 | 5 | 0 | 58 | 358.445 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.08 | 11.14 | -55.89 | 2 | 5 | 1 | 59 | 359.453 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.