| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2010 | 18 | No |
Popular Name: (2S)-N-[(3-nitrophenyl)methyl]pyrrolidine-2-carboxamide (2S)-N-[(3-nitrophenyl)methyl]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) | 0.93 | 4.59 | -43.94 | 3 | 6 | 1 | 92 | 250.278 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.93 | 3.35 | -13.49 | 2 | 6 | 0 | 87 | 249.27 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
