In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2009 | 30 | 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) | 3.93 | 11.39 | -63.14 | 1 | 7 | 1 | 65 | 450.968 | 9 | ↓ |
Hi High (pH 8-9.5) | 3.93 | 8.92 | -14.72 | 0 | 7 | 0 | 64 | 449.96 | 9 | ↓ |