In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 26 | 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) | 1.73 | 6.76 | -21.72 | 1 | 6 | 0 | 70 | 377.407 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.91 | 4.61 | -55.81 | 0 | 6 | -1 | 76 | 376.399 | 6 | ↓ |