In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 30th, 2006 | 25 | 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) | 5.73 | 8.55 | -14.07 | 2 | 4 | 0 | 62 | 348.789 | 2 | ↓ |
Lo Low (pH 4.5-6) | 5.73 | 8.82 | -29.72 | 3 | 4 | 1 | 63 | 349.797 | 2 | ↓ |