In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2004 | 22 | Yes |
Popular Name: 2,4-dihydroxybenzoic-acid-[2-[(2S,6S)-2,6-dimethylpiperidino]-2-keto-ethyl]-ester 2,4-dihydroxybenzoic-acid-[2-[(2…
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) | 2.55 | 4.64 | -11 | 2 | 6 | 0 | 87 | 307.346 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.55 | 5.64 | -51 | 1 | 6 | -1 | 90 | 306.338 | 4 | ↓ |