In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 8th, 2010 | 16 | 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) | -0.19 | 4.61 | -82.1 | 3 | 5 | 0 | 88 | 230.308 | 9 | ↓ |
Lo Low (pH 4.5-6) | -0.19 | 2.63 | -51.36 | 4 | 5 | 1 | 85 | 231.316 | 9 | ↓ |