| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2010 | 21 | Yes |
Popular Name: 5-[3-(cyanomethoxy)anilino]-3,3-dimethyl-5-oxo-pentanoic 5-[3-(cyanomethoxy)anilino]-3,3-…
| 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) | 1.88 | 6.51 | -54.59 | 1 | 6 | -1 | 102 | 289.311 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.88 | 4.53 | -18.09 | 2 | 6 | 0 | 99 | 290.319 | 7 | ↓ |
