In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 14th, 2009 | 29 | 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 |
---|---|---|---|---|---|---|---|---|---|---|
Lo Low (pH 4.5-6) | 3.75 | 12.43 | -98.76 | 2 | 5 | 2 | 40 | 413.587 | 7 | ↓ |