In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 14th, 2010 | 17 | Yes |
Popular Name: (2R)-N-[(2,4-difluorophenyl)methyl]pyrrolidine-2-carboxamide (2R)-N-[(2,4-difluorophenyl)meth…
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) | 1.25 | 3.99 | -38 | 3 | 3 | 1 | 46 | 241.261 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.25 | 2.59 | -6.89 | 2 | 3 | 0 | 41 | 240.253 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.