In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 30th, 2009 | 12 | 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) | 0.32 | -0.73 | -53.72 | 4 | 3 | 1 | 61 | 208.068 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.32 | -1.18 | -5.74 | 3 | 3 | 0 | 59 | 207.06 | 2 | ↓ |