In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 19 | 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) | 1.87 | 3.97 | -53.52 | 3 | 5 | -1 | 95 | 263.317 | 9 | ↓ |
Lo Low (pH 4.5-6) | 1.87 | 2.85 | -14.19 | 4 | 5 | 0 | 92 | 264.325 | 9 | ↓ |