In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 1st, 2009 | 37 | 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) | 0.87 | 6.93 | -12.34 | 4 | 11 | 0 | 172 | 525.595 | 9 | ↓ |
Mid Mid (pH 6-8) | 0.87 | 7.34 | -54.82 | 5 | 11 | 1 | 173 | 526.603 | 9 | ↓ |