In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 30th, 2010 | 18 | 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) | 0.11 | 3.14 | -57.75 | 2 | 6 | -1 | 98 | 257.31 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.11 | 1.1 | -13.71 | 3 | 6 | 0 | 95 | 258.318 | 6 | ↓ |