In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 11 | 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 | -1.85 | -40.41 | 4 | 4 | 1 | 68 | 161.225 | 4 | ↓ |
Hi High (pH 8-9.5) | -1.23 | -2.19 | -7.5 | 3 | 4 | 0 | 67 | 160.217 | 4 | ↓ |