In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2010 | 32 | 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) | 3.92 | 5.29 | -17.19 | 3 | 8 | 0 | 105 | 447.472 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.92 | 5.61 | -41.38 | 4 | 8 | 1 | 106 | 448.48 | 4 | ↓ |