In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2011 | 20 | Yes |
Popular Name: 2-(difluoromethyl)-6-(1-piperidyl)-1H-quinolin-4-one 2-(difluoromethyl)-6-(1-piperidy…
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) | 2.64 | 7.48 | -15.57 | 1 | 3 | 0 | 36 | 278.302 | 2 | ↓ |
Hi High (pH 8-9.5) | 3.94 | 6.15 | -47.61 | 0 | 3 | -1 | 39 | 277.294 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.