| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 10th, 2011 | 25 | Yes |
Popular Name: (2S,4R)-4-amino-1-(2,3-dimethylquinoxaline-6-carbonyl)-N-ethyl-pyrrolidine-2-carboxamide (2S,4R)-4-amino-1-(2,3-dimethylq…
| 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) | -0.42 | 1.55 | -77.64 | 4 | 7 | 1 | 103 | 342.423 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.42 | 1.25 | -21.25 | 3 | 7 | 0 | 101 | 341.415 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
