In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 20th, 2005 | 25 | 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) | -0.92 | -9.2 | -17.85 | 6 | 13 | 0 | 204 | 354.279 | 5 | ↓ |
Lo Low (pH 4.5-6) | -0.92 | -9.07 | -38.91 | 7 | 13 | 1 | 205 | 355.287 | 5 | ↓ |
Lo Low (pH 4.5-6) | -0.92 | -9.06 | -38.58 | 7 | 13 | 1 | 205 | 355.287 | 5 | ↓ |