In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 17 | No |
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) | 0.42 | 6.19 | -19.14 | 3 | 6 | 0 | 84 | 250.331 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.42 | 6.67 | -36.49 | 4 | 6 | 1 | 85 | 251.339 | 5 | ↓ |