| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 26th, 2004 | 20 | Yes |
Popular Name: [(3S)-3-(2,4-dihydroxybenzoyl)oxybutyl]-diethyl-ammonium [(3S)-3-(2,4-dihydroxybenzoyl)ox…
| 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) | 2.68 | 5.43 | -40.24 | 3 | 5 | 1 | 71 | 282.36 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.68 | 6.44 | -64.48 | 2 | 5 | 0 | 74 | 281.352 | 8 | ↓ |
