In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2009 | 31 | No |
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) | 1.54 | 8.31 | -14.07 | 2 | 8 | 0 | 116 | 416.437 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.54 | 8.74 | -62.72 | 3 | 8 | 1 | 118 | 417.445 | 3 | ↓ |