In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2009 | 10 | 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) | -1.66 | 2.19 | -36.34 | 2 | 4 | 0 | 66 | 147.174 | 6 | ↓ |
Hi High (pH 8-9.5) | -1.66 | 0.84 | -43.66 | 1 | 4 | -1 | 61 | 146.166 | 6 | ↓ |