| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 19th, 2011 | 20 | Yes |
Popular Name: (3S)-1-[2-(dimethylcarbamoyl)-4-pyridyl]-3-methyl-pyrrolidine-3-carboxylic (3S)-1-[2-(dimethylcarbamoyl)-4-…
| 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) | 0.64 | 6.35 | -47.46 | 0 | 6 | -1 | 77 | 276.316 | 3 | ↓ |
| Mid Mid (pH 6-8) | -3.41 | 6.42 | -52.53 | 1 | 6 | 0 | 79 | 277.324 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.64 | 6.93 | -46.95 | 1 | 6 | 0 | 78 | 277.324 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.64 | 6.38 | -57.18 | 1 | 6 | 0 | 78 | 277.324 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
