In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 18th, 2011 | 26 | Yes |
Popular Name: 3-[(3R)-3-[2-(4-fluoro-3-methyl-phenyl)-4-pyridyl]pyrrolidine-1-carbonyl]cyclobutanone 3-[(3R)-3-[2-(4-fluoro-3-methyl-…
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) | 2.95 | 10.1 | -14.66 | 0 | 4 | 0 | 50 | 352.409 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.95 | 10.44 | -47.49 | 1 | 4 | 1 | 52 | 353.417 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.