In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 5th, 2010 | 33 | Yes |
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) | 6.33 | 11.01 | -17.67 | 1 | 6 | 0 | 81 | 497.667 | 6 | ↓ |
Mid Mid (pH 6-8) | 6.33 | 11.03 | -64.14 | 0 | 6 | -1 | 83 | 496.659 | 6 | ↓ |