In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2009 | 25 | 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) | 3.70 | 8.7 | -50.22 | 3 | 5 | 1 | 70 | 366.551 | 9 | ↓ |
Hi High (pH 8-9.5) | 4.15 | 6.27 | -45.77 | 2 | 5 | 0 | 74 | 365.543 | 9 | ↓ |