| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2011 | 19 | Yes |
Popular Name: (2S)-2-cyclopropyl-3-[(2R)-2-methyl-1,4-oxazepan-4-yl]-2-(propylamino)propanenitrile (2S)-2-cyclopropyl-3-[(2R)-2-met…
| 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) | 2.20 | 6.43 | -43.86 | 2 | 4 | 1 | 49 | 266.409 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.20 | 4.42 | -8.18 | 1 | 4 | 0 | 48 | 265.401 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
