In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2009 | 35 | 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) | 3.21 | 10.52 | -63.19 | 0 | 7 | -1 | 92 | 469.517 | 10 | ↓ |
Lo Low (pH 4.5-6) | 3.21 | 9.75 | -17.97 | 1 | 7 | 0 | 89 | 470.525 | 10 | ↓ |