In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2009 | 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) | -0.84 | 7.74 | -43.6 | 2 | 5 | 0 | 75 | 231.255 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.84 | 6.39 | -46.01 | 1 | 5 | -1 | 70 | 230.247 | 5 | ↓ |
Mid Mid (pH 6-8) | -0.84 | 8.25 | -71.59 | 3 | 5 | 1 | 76 | 232.263 | 5 | ↓ |