In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2009 | 24 | 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) | 4.22 | 10.06 | -99.37 | 0 | 4 | -2 | 80 | 334.456 | 6 | ↓ |
Lo Low (pH 4.5-6) | 4.22 | 8.94 | -51.35 | 1 | 4 | -1 | 77 | 335.464 | 6 | ↓ |