In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 20 | 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) | 2.87 | 7.4 | -37.32 | 1 | 3 | 1 | 21 | 274.432 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.87 | 5.1 | -4.07 | 0 | 3 | 0 | 19 | 273.424 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.87 | 7.8 | -86.31 | 2 | 3 | 2 | 22 | 275.44 | 3 | ↓ |