In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 37 | No |
None
None
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) | 5.48 | 9.81 | -11.57 | 0 | 7 | 0 | 70 | 519.981 | 5 | ↓ |
Mid Mid (pH 6-8) | 5.48 | 12.67 | -53.62 | 1 | 7 | 1 | 72 | 520.989 | 5 | ↓ |