In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2009 | 19 | No |
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) | 2.36 | 8.03 | -36.68 | 1 | 4 | 1 | 40 | 264.345 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.36 | 5.56 | -7.04 | 0 | 4 | 0 | 39 | 263.337 | 7 | ↓ |