In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2010 | 31 | Yes |
Popular Name: 1-[2-(4-fluoroanilino)-2-oxo-ethyl]-N-[3-(methanesulfonamido)phenyl]piperidine-4-carboxamide 1-[2-(4-fluoroanilino)-2-oxo-eth…
None
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) | 2.46 | 5.46 | -67.06 | 4 | 8 | 1 | 109 | 449.528 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.46 | 3.33 | -56.18 | 2 | 8 | -1 | 110 | 447.512 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.46 | 5.52 | -85.58 | 3 | 8 | 0 | 111 | 448.52 | 7 | ↓ |