In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 20 | 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) | 3.26 | 4.09 | -12.03 | 1 | 5 | 0 | 68 | 268.272 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.06 | 5.69 | -65.07 | 2 | 5 | 1 | 69 | 269.28 | 2 | ↓ |