In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 30th, 2008 | 26 | No |
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) | 3.00 | 6.92 | -56.83 | 1 | 5 | -1 | 81 | 415.263 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.00 | 5.62 | -18.66 | 2 | 5 | 0 | 78 | 416.271 | 5 | ↓ |