In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 19 | 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) | -0.59 | 6.99 | -49.89 | 2 | 6 | 1 | 68 | 264.353 | 6 | ↓ |
Hi High (pH 8-9.5) | -0.59 | 5.63 | -12.02 | 1 | 6 | 0 | 63 | 263.345 | 6 | ↓ |