In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 12th, 2007 | 37 | 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) | 5.42 | 13.14 | -51.33 | 0 | 9 | -1 | 128 | 514.539 | 7 | ↓ |
Mid Mid (pH 6-8) | 5.87 | 13.01 | -17.09 | 1 | 9 | 0 | 126 | 515.547 | 6 | ↓ |