In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2010 | 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) | 5.20 | 9.76 | -17.39 | 1 | 6 | 0 | 67 | 534.579 | 4 | ↓ |
Mid Mid (pH 6-8) | 5.20 | 9.65 | -40.8 | 0 | 6 | -1 | 69 | 533.571 | 4 | ↓ |