In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 2nd, 2008 | 14 | 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) | 1.86 | 4.43 | -13.63 | 3 | 3 | 0 | 51 | 209.318 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.86 | 4.72 | -43.25 | 4 | 3 | 1 | 52 | 210.326 | 4 | ↓ |