In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 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) | 1.32 | 4.61 | -96.4 | 0 | 6 | -2 | 112 | 300.723 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.32 | 4.52 | -51.96 | 1 | 6 | -1 | 110 | 301.731 | 6 | ↓ |