| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 17th, 2011 | 21 | No |
Popular Name: 5-[(3-hydroxypropylamino)methyl]-7-nitro-1,4-dihydroquinoxaline-2,3-dione 5-[(3-hydroxypropylamino)methyl]…
| 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) | -1.20 | 0.58 | -66.5 | 5 | 9 | 1 | 148 | 295.275 | 6 | ↓ |
| Hi High (pH 8-9.5) | -0.30 | -2.99 | -44.71 | 3 | 9 | -1 | 147 | 293.259 | 6 | ↓ |
| Mid Mid (pH 6-8) | -1.20 | -0.8 | -14.04 | 4 | 9 | 0 | 144 | 294.267 | 6 | ↓ |
| Mid Mid (pH 6-8) | -0.30 | -1.59 | -76.79 | 4 | 9 | 0 | 151 | 294.267 | 6 | ↓ |
