In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 15 | 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) | 1.16 | 5.76 | -40.41 | 3 | 2 | 1 | 37 | 208.325 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.16 | 5.47 | -1.74 | 2 | 2 | 0 | 35 | 207.317 | 6 | ↓ |