In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 16 | 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) | 1.83 | 6.23 | -35.45 | 2 | 4 | 1 | 34 | 225.36 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.83 | 4.11 | -4.26 | 1 | 4 | 0 | 33 | 224.352 | 8 | ↓ |