In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 26 | 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) | 4.46 | 11.78 | -13.69 | 0 | 4 | 0 | 36 | 344.414 | 6 | ↓ |
Lo Low (pH 4.5-6) | 4.46 | 12.46 | -30.15 | 1 | 4 | 1 | 38 | 345.422 | 6 | ↓ |