In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 15th, 2010 | 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) | 6.05 | 13.54 | -10.77 | 0 | 2 | 0 | 18 | 332.834 | 4 | ↓ |
Lo Low (pH 4.5-6) | 6.05 | 13.95 | -23.82 | 1 | 2 | 1 | 19 | 333.842 | 4 | ↓ |