In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2005 | 24 | Yes |
None
None
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) | 2.61 | -1.37 | -121.52 | 2 | 5 | 2 | 40 | 349.862 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.61 | -1.18 | -185.71 | 3 | 5 | 3 | 41 | 350.87 | 4 | ↓ |