In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 34 | Yes |
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) | 3.15 | 6.93 | -20.18 | 2 | 8 | 0 | 105 | 483.59 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.15 | 9.39 | -53.82 | 3 | 8 | 1 | 106 | 484.598 | 10 | ↓ |