In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 15th, 2006 | 27 | 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) | 4.30 | 10.72 | -9.37 | 1 | 5 | 0 | 53 | 375.557 | 8 | ↓ |
Lo Low (pH 4.5-6) | 4.30 | 10.82 | -27.84 | 2 | 5 | 1 | 54 | 376.565 | 8 | ↓ |