In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 19th, 2011 | 19 | Yes |
Popular Name: 2-(4-fluorophenyl)-N-[(1R)-1-(2-pyridyl)ethyl]acetamide 2-(4-fluorophenyl)-N-[(1R)-1-(2-…
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) | 2.17 | 6.62 | -9.34 | 1 | 3 | 0 | 42 | 258.296 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.17 | 6.8 | -41.57 | 2 | 3 | 1 | 43 | 259.304 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.