In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 8th, 2009 | 13 | 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) | -4.02 | -3.06 | -47.94 | 3 | 7 | -1 | 135 | 191.115 | 5 | ↓ |
Hi High (pH 8-9.5) | -4.02 | -2.56 | -103.14 | 2 | 7 | -2 | 138 | 190.107 | 5 | ↓ |