In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 25th, 2009 | 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) | 0.85 | 8.8 | -12.54 | 0 | 6 | 0 | 57 | 350.422 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.85 | 8.86 | -40.42 | 1 | 6 | 1 | 58 | 351.43 | 2 | ↓ |