In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 19 | Yes |
Popular Name: 5-fluoro-2-[(2R)-2-(3-pyridyl)pyrrolidin-1-yl]aniline 5-fluoro-2-[(2R)-2-(3-pyridyl)py…
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) | 2.36 | 6.85 | -5.55 | 2 | 3 | 0 | 42 | 257.312 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.36 | 7.3 | -33.6 | 3 | 3 | 1 | 43 | 258.32 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.