| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 28th, 2009 | 30 | No |
Popular Name: (2S)-2,4-bis[(3,4,5-trihydroxybenzoyl)amino]butanoic (2S)-2,4-bis[(3,4,5-trihydroxybe…
| 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) | -2.52 | -7.22 | -64.15 | 8 | 12 | -1 | 220 | 421.338 | 7 | ↓ |
| Hi High (pH 8-9.5) | -2.52 | -6.31 | -112.47 | 7 | 12 | -2 | 223 | 420.33 | 7 | ↓ |
