| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2011 | 21 | Yes |
Popular Name: (2S)-2-cyclopropyl-2-(ethylamino)-3-(4-methyl-2,3-dihydroquinoxalin-1-yl)propanenitrile (2S)-2-cyclopropyl-2-(ethylamino…
| 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) | 2.83 | 7.21 | -8.13 | 1 | 4 | 0 | 42 | 284.407 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.83 | 7.53 | -37.23 | 2 | 4 | 1 | 43 | 285.415 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.83 | 8.54 | -103.36 | 3 | 4 | 2 | 48 | 286.423 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
