In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 23rd, 2009 | 18 | Yes |
None
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) | -0.76 | 5.64 | -45.75 | 3 | 5 | 0 | 90 | 246.266 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.76 | 5.25 | -49.75 | 2 | 5 | -1 | 88 | 245.258 | 3 | ↓ |