In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 27th, 2004 | 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) | 4.70 | 9.77 | -56.42 | 1 | 5 | -1 | 71 | 413.247 | 2 | ↓ |
Lo Low (pH 4.5-6) | 4.70 | 7.8 | -9.4 | 2 | 5 | 0 | 68 | 414.255 | 2 | ↓ |