In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 18 | 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) | 0.69 | 2.19 | -45.09 | 3 | 5 | 1 | 65 | 256.322 | 9 | ↓ |
Hi High (pH 8-9.5) | 0.69 | 0.7 | -11.76 | 2 | 5 | 0 | 60 | 255.314 | 9 | ↓ |