In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 2nd, 2008 | 18 | 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) | 0.82 | 1.37 | -12.4 | 0 | 6 | 0 | 80 | 267.31 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.82 | 2.33 | -37.48 | 1 | 6 | 1 | 81 | 268.318 | 3 | ↓ |