In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 6th, 2006 | 19 | 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) | 3.31 | 7.66 | -9.58 | 1 | 3 | 0 | 42 | 272.373 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.31 | 7.94 | -40.26 | 2 | 3 | 1 | 43 | 273.381 | 5 | ↓ |