In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 21 | 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) | 0.13 | 7.84 | -125.69 | 1 | 7 | -2 | 126 | 291.259 | 7 | ↓ |
Lo Low (pH 4.5-6) | 0.13 | 5.87 | -74.11 | 2 | 7 | -1 | 124 | 292.267 | 7 | ↓ |