In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 15th, 2006 | 26 | 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) | 3.97 | 5.98 | -7.75 | 3 | 5 | 0 | 88 | 362.82 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.97 | 6.21 | -54.82 | 4 | 5 | 1 | 89 | 363.828 | 2 | ↓ |