| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 15th, 2010 | 24 | No |
Popular Name: 2-butanoyl-5,5-dimethyl-3-(4-nitroanilino)cyclohex-2-en-1-one 2-butanoyl-5,5-dimethyl-3-(4-nit…
| 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) | 3.61 | 10.2 | -17.41 | 0 | 6 | 0 | 92 | 330.384 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.20 | 8.87 | -39.31 | 0 | 6 | -1 | 98 | 329.376 | 4 | ↓ |
