In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2009 | 34 | 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) | 3.54 | 9.56 | -29.04 | 2 | 7 | 0 | 94 | 471.586 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.54 | 10.47 | -46.62 | 3 | 7 | 1 | 95 | 472.594 | 5 | ↓ |