In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 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) | 3.45 | 6.99 | -4.75 | 1 | 3 | 0 | 34 | 276.767 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.45 | 7.45 | -35.19 | 2 | 3 | 1 | 35 | 277.775 | 6 | ↓ |