In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 28th, 2009 | 11 | 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) | -0.64 | -1.5 | -8.13 | 1 | 4 | 0 | 50 | 159.185 | 3 | ↓ |
Lo Low (pH 4.5-6) | -0.64 | 0.77 | -42.75 | 2 | 4 | 1 | 51 | 160.193 | 3 | ↓ |
Lo Low (pH 4.5-6) | -0.64 | 0.75 | -42.92 | 2 | 4 | 1 | 51 | 160.193 | 3 | ↓ |