In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2006 | 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) | 2.48 | 8.79 | -9.04 | 1 | 5 | 0 | 58 | 231.303 | 1 | ↓ |
Mid Mid (pH 6-8) | 2.48 | 7.71 | -40 | 2 | 5 | 1 | 59 | 232.311 | 1 | ↓ |