In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 14 | 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) | 0.67 | 1.87 | -49.57 | 4 | 3 | 1 | 57 | 197.233 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.67 | 1.46 | -10.81 | 3 | 3 | 0 | 55 | 196.225 | 4 | ↓ |