In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 5th, 2007 | 36 | 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) | 2.92 | 9.63 | -56.66 | 2 | 10 | 1 | 126 | 496.54 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.33 | 10.31 | -67.64 | 1 | 10 | 1 | 123 | 496.54 | 9 | ↓ |