In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 3rd, 2011 | 26 | Yes |
Popular Name: 1-[4-(4-ethylpiperazin-1-yl)-3-fluoro-benzoyl]piperidine-4-carboxamide 1-[4-(4-ethylpiperazin-1-yl)-3-f…
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) | 0.87 | 6.49 | -57.06 | 3 | 6 | 1 | 71 | 363.457 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.87 | 4.28 | -18.82 | 2 | 6 | 0 | 70 | 362.449 | 4 | ↓ |