| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2011 | 18 | Yes |
Popular Name: (2R)-2-cyclopropyl-2-(isopropylamino)-3-(1,4-oxazepan-4-yl)propanenitrile (2R)-2-cyclopropyl-2-(isopropyla…
| 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) | 1.63 | 5.8 | -40.67 | 2 | 4 | 1 | 49 | 252.382 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.63 | 4.26 | -4.2 | 1 | 4 | 0 | 48 | 251.374 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
