In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 23rd, 2009 | 38 | 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) | 6.61 | 14.54 | -11.68 | 0 | 5 | 0 | 42 | 512.694 | 10 | ↓ |
Mid Mid (pH 6-8) | 6.61 | 16.98 | -53.35 | 1 | 5 | 1 | 43 | 513.702 | 10 | ↓ |