In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2009 | 30 | No |
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) | 6.17 | 10.78 | -51.99 | 0 | 7 | -1 | 104 | 424.502 | 8 | ↓ |
Mid Mid (pH 6-8) | 5.72 | 11.89 | -15.3 | 1 | 7 | 0 | 101 | 425.51 | 8 | ↓ |