In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2004 | 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) | 4.44 | 8.07 | -7.29 | 1 | 2 | 0 | 29 | 314.599 | 3 | ↓ |
Lo Low (pH 4.5-6) | 4.51 | 6.46 | -28.41 | 2 | 2 | 1 | 34 | 315.607 | 3 | ↓ |