In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 14th, 2009 | 28 | 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) | 1.15 | 3.85 | -14.98 | 1 | 9 | 0 | 100 | 390.44 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.15 | 6.12 | -50.97 | 2 | 9 | 1 | 101 | 391.448 | 5 | ↓ |