In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 16th, 2004 | 39 | 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) | 2.41 | 9.79 | -21.89 | 1 | 11 | 0 | 124 | 532.601 | 11 | ↓ |
Mid Mid (pH 6-8) | 2.41 | 11.38 | -60.16 | 2 | 11 | 1 | 126 | 533.609 | 11 | ↓ |