In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2008 | 17 | 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) | 1.33 | 1 | -38.58 | 2 | 5 | -1 | 87 | 272.306 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.26 | 1.42 | -18.82 | 3 | 5 | 0 | 88 | 273.314 | 2 | ↓ |