In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 27 | 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) | 3.81 | 9.56 | -37.69 | 1 | 5 | -1 | 70 | 424.568 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.56 | 10.66 | -15.22 | 2 | 5 | 0 | 63 | 425.576 | 9 | ↓ |