In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2009 | 15 | No |
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) | 0.40 | -1.01 | -58 | 6 | 4 | 1 | 84 | 211.216 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.40 | -0.54 | -80.33 | 5 | 4 | 0 | 87 | 210.208 | 2 | ↓ |