In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2010 | 14 | Yes |
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) | -2.69 | 1.78 | -109.71 | 2 | 7 | -2 | 121 | 202.166 | 5 | ↓ |
Lo Low (pH 4.5-6) | -2.69 | -0.26 | -56.98 | 3 | 7 | -1 | 119 | 203.174 | 5 | ↓ |