In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 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) | 2.33 | 8.78 | -47.4 | 2 | 6 | 1 | 66 | 360.478 | 10 | ↓ |
Hi High (pH 8-9.5) | 2.33 | 7.44 | -11.48 | 1 | 6 | 0 | 62 | 359.47 | 10 | ↓ |