In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2009 | 17 | 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) | 4.06 | 8.91 | -9.89 | 0 | 1 | 0 | 13 | 223.25 | 1 | ↓ |
Lo Low (pH 4.5-6) | 4.06 | 9.15 | -27.05 | 1 | 1 | 1 | 14 | 224.258 | 1 | ↓ |