| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2011 | 20 | Yes |
Popular Name: (2S)-2-cyclopropyl-2-(methylamino)-3-(4-methyl-2,3-dihydroquinoxalin-1-yl)propanenitrile (2S)-2-cyclopropyl-2-(methylamin…
| 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) | 2.45 | 6.24 | -7.81 | 1 | 4 | 0 | 42 | 270.38 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.45 | 6.61 | -38.02 | 2 | 4 | 1 | 43 | 271.388 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.45 | 7.79 | -106.22 | 3 | 4 | 2 | 48 | 272.396 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
