In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 7th, 2008 | 28 | Yes |
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) | 3.69 | 5.13 | -66.61 | 2 | 6 | 1 | 71 | 451.302 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.69 | 6.01 | -19.58 | 1 | 6 | 0 | 70 | 450.294 | 5 | ↓ |