In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 17 | 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) | -0.01 | -1.59 | -51.48 | 7 | 6 | 1 | 112 | 237.283 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.01 | -1.92 | -17.22 | 6 | 6 | 0 | 110 | 236.275 | 4 | ↓ |