In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 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) | 3.90 | 10.26 | -54.39 | 0 | 4 | -1 | 60 | 268.377 | 10 | ↓ |
Lo Low (pH 4.5-6) | 3.90 | 8.3 | -11.96 | 1 | 4 | 0 | 58 | 269.385 | 10 | ↓ |