In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 25th, 2009 | 21 | 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) | 3.78 | 8.13 | -10.32 | 1 | 3 | 0 | 42 | 276.339 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.85 | 7.14 | -28.43 | 2 | 3 | 1 | 47 | 277.347 | 2 | ↓ |