In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 8th, 2009 | 36 | 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) | 0.85 | 9.71 | -59.83 | 3 | 11 | -1 | 171 | 523.946 | 15 | ↓ |
Lo Low (pH 4.5-6) | 0.85 | 8.58 | -40.59 | 4 | 11 | 0 | 168 | 524.954 | 15 | ↓ |