| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 20 | Yes |
Popular Name: (3R)-3-[methyl-(2-oxo-2-pyrrolidin-1-yl-ethyl)amino]-3-phenyl-propanenitrile (3R)-3-[methyl-(2-oxo-2-pyrrolid…
| 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) | 1.14 | 6.71 | -11.05 | 0 | 4 | 0 | 47 | 271.364 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.14 | 8.72 | -41.02 | 1 | 4 | 1 | 49 | 272.372 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
