In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2008 | 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) | 3.28 | 10.37 | -54.21 | 0 | 9 | -1 | 119 | 478.525 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.28 | 12.7 | -74.46 | 1 | 9 | 0 | 120 | 479.533 | 8 | ↓ |