In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 27th, 2011 | 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) | 3.41 | 9.57 | -52.17 | 0 | 4 | -1 | 60 | 256.366 | 11 | ↓ |
Lo Low (pH 4.5-6) | 3.41 | 7.6 | -12.47 | 1 | 4 | 0 | 58 | 257.374 | 11 | ↓ |