In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 15 | 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) | 0.28 | 3.92 | -33.54 | 4 | 4 | 1 | 68 | 207.301 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.28 | 4 | -5.46 | 3 | 4 | 0 | 66 | 206.293 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.28 | 4.33 | -85.94 | 5 | 4 | 2 | 69 | 208.309 | 4 | ↓ |