In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 16th, 2004 | 22 | 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) | 3.08 | -0.63 | -14.71 | 2 | 5 | 0 | 71 | 317.776 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.08 | -0.98 | -33.38 | 3 | 5 | 1 | 72 | 318.784 | 4 | ↓ |