In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 10th, 2009 | 26 | 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) | 5.86 | 13.32 | -51.71 | 0 | 3 | -1 | 53 | 346.45 | 9 | ↓ |
Lo Low (pH 4.5-6) | 5.86 | 13.73 | -71.12 | 1 | 3 | 0 | 54 | 347.458 | 9 | ↓ |