In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 23rd, 2009 | 33 | 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) | 6.92 | 10.79 | -43.61 | 0 | 5 | -1 | 64 | 505.081 | 11 | ↓ |
Lo Low (pH 4.5-6) | 6.46 | 12.88 | -12.42 | 1 | 5 | 0 | 61 | 506.089 | 11 | ↓ |