| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 18 | Yes |
Popular Name: 2-[(2-cyclopropyl-2-keto-ethyl)thio]-4,5,6-trimethyl-nicotinonitrile 2-[(2-cyclopropyl-2-keto-ethyl)t…
| 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) | 2.58 | 1.97 | -11.44 | 0 | 3 | 0 | 53 | 260.362 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.58 | 2.08 | -40.94 | 1 | 3 | 1 | 55 | 261.37 | 4 | ↓ |
