In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 23rd, 2009 | 10 | 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) | -1.23 | -1.07 | -95.71 | 5 | 3 | 2 | 47 | 145.25 | 2 | ↓ |
Hi High (pH 8-9.5) | -1.23 | -2.41 | -40.06 | 4 | 3 | 1 | 43 | 144.242 | 2 | ↓ |