| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 12th, 2010 | 18 | Yes |
Popular Name: 2-(4-amino-2-chloro-phenyl)-5,5-dimethyl-cyclohexane-1,3-dione 2-(4-amino-2-chloro-phenyl)-5,5-…
| 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) | 2.25 | 5.7 | -39.65 | 2 | 3 | -1 | 66 | 264.732 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.25 | 4.25 | -9.35 | 3 | 3 | 0 | 63 | 265.74 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.49 | 5.87 | -9.9 | 2 | 3 | 0 | 60 | 265.74 | 1 | ↓ |
