In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2008 | 22 | No |
None
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) | 1.58 | 5.44 | -93.18 | 0 | 6 | -2 | 102 | 297.266 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.58 | 4.64 | -64.34 | 1 | 6 | -1 | 99 | 298.274 | 4 | ↓ |