In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 13th, 2010 | 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) | 4.74 | 10.4 | -6.55 | 0 | 1 | 0 | 13 | 245.325 | 2 | ↓ |
Lo Low (pH 4.5-6) | 4.74 | 10.36 | -28.77 | 1 | 1 | 1 | 14 | 246.333 | 2 | ↓ |