| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2011 | 17 | Yes |
Popular Name: (3S)-4-(2-ethylbutyl)-3-methyl-2,3-dihydro-1H-quinoxaline (3S)-4-(2-ethylbutyl)-3-methyl-2…
| 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) | 4.17 | 7.09 | -28.76 | 2 | 2 | 1 | 16 | 233.379 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.17 | 7.75 | -3.05 | 1 | 2 | 0 | 15 | 232.371 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
