| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 21st, 2011 | 20 | Yes |
Popular Name: (2S)-2-amino-2-cyclopropyl-3-(4-methyl-2,3-dihydroquinoxalin-1-yl)propanoic (2S)-2-amino-2-cyclopropyl-3-(4-…
| 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) | -0.44 | 6.52 | -31.08 | 3 | 5 | 0 | 74 | 275.352 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.44 | 6.26 | -46.72 | 2 | 5 | -1 | 73 | 274.344 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.44 | 7.27 | -75.05 | 4 | 5 | 1 | 75 | 276.36 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
