In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2005 | 26 | 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) | 4.63 | 13 | -18.4 | 1 | 5 | 0 | 51 | 350.466 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.63 | 12.6 | -46.2 | 2 | 5 | 1 | 56 | 351.474 | 4 | ↓ |