| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 18th, 2011 | 23 | No |
Popular Name: (2R)-N-carbamoyl-2-[(3R)-3-[[(3-cyano-2-pyridyl)amino]methyl]pyrrolidin-1-yl]propanamide (2R)-N-carbamoyl-2-[(3R)-3-[[(3-…
| 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) | -0.15 | 3.97 | -51.86 | 5 | 8 | 1 | 125 | 317.373 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.15 | 1.6 | -22.81 | 4 | 8 | 0 | 124 | 316.365 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
