| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2009 | 21 | No |
Popular Name: 1-(4-methyl-3-nitro-phenyl)-3-(4-pyridyl)propane-1,3-dione 1-(4-methyl-3-nitro-phenyl)-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) | 3.12 | 6.86 | -15.06 | 0 | 6 | 0 | 99 | 283.263 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.93 | 9.71 | -28.35 | 0 | 6 | 0 | 93 | 284.271 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
