In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2010 | 18 | Yes |
Popular Name: 2-[4-[(3-fluoro-2-pyridyl)amino]-1-piperidyl]acetamide 2-[4-[(3-fluoro-2-pyridyl)amino]…
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) | 0.16 | 3.03 | -41.03 | 4 | 5 | 1 | 72 | 253.301 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.16 | 0.83 | -10.47 | 3 | 5 | 0 | 71 | 252.293 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.16 | 3.37 | -96.06 | 5 | 5 | 2 | 74 | 254.309 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.