In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2004 | 19 | Yes |
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) | 4.98 | 6.79 | -4.61 | 0 | 2 | 0 | 22 | 308.086 | 3 | ↓ |
Lo Low (pH 4.5-6) | 4.98 | 7.47 | -32.97 | 1 | 2 | 1 | 23 | 309.094 | 3 | ↓ |