In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 18th, 2008 | 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) | 7.63 | 15.9 | -12.89 | 0 | 5 | 0 | 56 | 467.594 | 2 | ↓ |
Lo Low (pH 4.5-6) | 7.63 | 14.19 | -24.83 | 1 | 5 | 1 | 58 | 468.602 | 2 | ↓ |
Lo Low (pH 4.5-6) | 7.63 | 15.98 | -23.15 | 1 | 5 | 1 | 58 | 468.602 | 2 | ↓ |