In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2006 | 29 | 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) | 0.46 | 8.69 | -12.39 | 3 | 9 | 0 | 130 | 392.419 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.46 | 8.07 | -43.09 | 4 | 9 | 1 | 132 | 393.427 | 4 | ↓ |