In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 16 | 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) | 1.97 | 4.77 | -5.58 | 1 | 3 | 0 | 34 | 214.268 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.97 | 5.2 | -36.71 | 2 | 3 | 1 | 35 | 215.276 | 4 | ↓ |