In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 25th, 2010 | 16 | 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) | 2.73 | 8.67 | -4.25 | 1 | 3 | 0 | 38 | 217.316 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.73 | 9.04 | -28.48 | 2 | 3 | 1 | 39 | 218.324 | 5 | ↓ |