In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2010 | 27 | 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) | -3.15 | -2.1 | -84.23 | 7 | 13 | 0 | 205 | 420.344 | 4 | ↓ |
Hi High (pH 8-9.5) | -3.15 | -2.49 | -61.13 | 6 | 13 | -1 | 204 | 419.336 | 4 | ↓ |