In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2008 | 28 | 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) | 4.64 | 10.65 | -45.93 | 0 | 5 | -1 | 67 | 458.357 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.18 | 11.73 | -10.54 | 1 | 5 | 0 | 64 | 459.365 | 4 | ↓ |