| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 25th, 2009 | 15 | Yes |
Popular Name: Ethanone, 1-(2,3-dihydroxy-1-naphthalenyl)- (9CI) Ethanone, 1-(2,3-dihydroxy-1-nap…
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CAS Number: 91368-52-4
| 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) | 2.21 | 2.42 | -8.63 | 2 | 3 | 0 | 58 | 202.209 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.21 | 3.36 | -49 | 1 | 3 | -1 | 60 | 201.201 | 1 | ↓ |
