| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2011 | 17 | No |
Popular Name: (2R)-2-cyclopropyl-2-(ethylamino)-3-tetrahydropyran-4-ylsulfanyl-propanenitrile (2R)-2-cyclopropyl-2-(ethylamino…
| 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) | 2.09 | 5.03 | -7.88 | 1 | 3 | 0 | 45 | 254.399 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.09 | 6.22 | -42.51 | 2 | 3 | 1 | 50 | 255.407 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
