In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 11th, 2010 | 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) | -0.49 | -0.64 | -43.27 | 5 | 5 | 1 | 91 | 202.278 | 8 | ↓ |
Hi High (pH 8-9.5) | -0.49 | -2.63 | -12.91 | 4 | 5 | 0 | 89 | 201.27 | 8 | ↓ |