In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 16 | 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) | 0.79 | 2.05 | -45.58 | 4 | 4 | 1 | 66 | 223.296 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.79 | 1.72 | -10.57 | 3 | 4 | 0 | 64 | 222.288 | 5 | ↓ |