In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 17 | 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) | 1.18 | 3.81 | -57.41 | 3 | 6 | 1 | 92 | 241.267 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.18 | 2.44 | -13.57 | 2 | 6 | 0 | 87 | 240.259 | 7 | ↓ |