In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 19 | 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) | 1.32 | 4.39 | -43.39 | 3 | 4 | 1 | 46 | 258.345 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.32 | 5.47 | -114.29 | 4 | 4 | 2 | 50 | 259.353 | 2 | ↓ |