| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 2nd, 2009 | 34 | No |
Popular Name: 1-Nitro-5-hydroxy-6-glutathionyl-5,6-dihydronaphthalene 1-Nitro-5-hydroxy-6-glutathionyl…
None
| 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) | -3.99 | -1.4 | -112.76 | 6 | 13 | -1 | 239 | 495.49 | 12 | ↓ |
| Hi High (pH 8-9.5) | -3.99 | -1.57 | -139.95 | 5 | 13 | -2 | 238 | 494.482 | 12 | ↓ |
| Hi High (pH 8-9.5) | -3.99 | -3.03 | -141.07 | 5 | 13 | -2 | 238 | 494.482 | 12 | ↓ |
| Hi High (pH 8-9.5) | -3.99 | -2.57 | -128.89 | 5 | 13 | -2 | 238 | 494.482 | 12 | ↓ |
| Hi High (pH 8-9.5) | -3.99 | -2 | -124.07 | 5 | 13 | -2 | 238 | 494.482 | 12 | ↓ |
| Hi High (pH 8-9.5) | -4.31 | 3.7 | -110.34 | 5 | 13 | -2 | 231 | 494.482 | 12 | ↓ |
No pre-computed analogs available. Try a structural similarity search.