In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 30th, 2007 | 35 | 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) | 2.03 | 8.61 | -51.88 | 2 | 9 | 1 | 103 | 485.557 | 10 | ↓ |
Mid Mid (pH 6-8) | 1.44 | 9.39 | -61.61 | 1 | 9 | 1 | 100 | 485.557 | 10 | ↓ |