In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 21st, 2008 | 23 | 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) | -0.06 | -1.4 | -16.92 | 5 | 9 | 0 | 140 | 341.393 | 6 | ↓ |
Lo Low (pH 4.5-6) | -0.06 | -1.14 | -37.13 | 6 | 9 | 1 | 141 | 342.401 | 6 | ↓ |
Lo Low (pH 4.5-6) | -0.06 | -5.51 | -38.58 | 6 | 9 | 1 | 141 | 342.401 | 6 | ↓ |