In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 15th, 2010 | 19 | Yes |
Popular Name: 2-fluoro-N-[2-(4-methylpiperazin-1-yl)ethyl]pyridine-4-carboxamide 2-fluoro-N-[2-(4-methylpiperazin…
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) | 0.27 | 2.52 | -45.47 | 2 | 5 | 1 | 50 | 267.328 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.27 | 2.4 | -50.68 | 2 | 5 | 1 | 50 | 267.328 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.27 | 0.14 | -11.8 | 1 | 5 | 0 | 48 | 266.32 | 4 | ↓ |