In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 35 | 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) | 3.16 | 10.14 | -61.91 | 1 | 10 | 0 | 129 | 483.521 | 11 | ↓ |
Hi High (pH 8-9.5) | 3.16 | 7.79 | -51.91 | 0 | 10 | -1 | 128 | 482.513 | 11 | ↓ |