In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2008 | 13 | No |
Popular Name: 5,5-dimethyl-2-(methylaminomethylene)cyclohexane-1,3-dione 5,5-dimethyl-2-(methylaminomethy…
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) | 1.03 | 3.44 | -38.63 | 0 | 3 | -1 | 52 | 180.227 | 1 | ↓ |
Mid Mid (pH 6-8) | 0.11 | 4 | -8.94 | 1 | 3 | 0 | 46 | 181.235 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.