In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 3rd, 2009 | 18 | 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) | 2.13 | 5.68 | -39.65 | 3 | 4 | 1 | 47 | 263.39 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.13 | 3.47 | -4.52 | 2 | 4 | 0 | 45 | 262.382 | 2 | ↓ |