In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 15 | 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) | 2.92 | 6.63 | -10.57 | 1 | 3 | 0 | 42 | 288.576 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.92 | 6.17 | -35.28 | 0 | 3 | -1 | 40 | 287.568 | 4 | ↓ |