In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 19th, 2007 | 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) | 5.12 | -4.12 | -17.14 | 1 | 7 | 0 | 88 | 489.663 | 8 | ↓ |
Lo Low (pH 4.5-6) | 5.12 | -4.08 | -40.7 | 2 | 7 | 1 | 89 | 490.671 | 8 | ↓ |