| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 7th, 2010 | 15 | Yes |
Popular Name: 5-(3-Aminophenyl)cyclohexane-1,3-dione 5-(3-Aminophenyl)cyclohexane-1,3…
Find On: PubMed — Wikipedia — Google
CAS Number: [1215521-75-7]
| 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) | 0.44 | 4.36 | -10.31 | 2 | 3 | 0 | 60 | 203.241 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.19 | 4.16 | -42.45 | 2 | 3 | -1 | 66 | 202.233 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
