In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2008 | 31 | 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) | 3.48 | 11.28 | -47.65 | 0 | 5 | -1 | 73 | 415.444 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.48 | 10.47 | -14.47 | 1 | 5 | 0 | 71 | 416.452 | 5 | ↓ |