In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2010 | 33 | 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) | 5.31 | 14.13 | -12.03 | 0 | 5 | 0 | 63 | 438.527 | 4 | ↓ |
Lo Low (pH 4.5-6) | 5.31 | 14.6 | -38.39 | 1 | 5 | 1 | 65 | 439.535 | 4 | ↓ |