In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2008 | 33 | Yes |
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) | 3.77 | 11 | -19.07 | 1 | 7 | 0 | 78 | 442.519 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.77 | 11.35 | -44.74 | 2 | 7 | 1 | 80 | 443.527 | 4 | ↓ |