In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2010 | 14 | 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) | 0.77 | 5.03 | -43.45 | 1 | 4 | 0 | 48 | 202.298 | 8 | ↓ |
Mid Mid (pH 6-8) | 0.77 | 7.48 | -96.81 | 2 | 4 | 1 | 49 | 203.306 | 8 | ↓ |