In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2008 | 18 | 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) | 3.77 | 8.41 | -13.25 | 2 | 3 | 0 | 42 | 265.426 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.77 | 8.84 | -44.55 | 3 | 3 | 1 | 43 | 266.434 | 8 | ↓ |