| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 2nd, 2011 | 18 | Yes |
Popular Name: (2R)-4-[(2R)-2-methyl-1,4-oxazepan-4-yl]-2-(propylamino)butanamide (2R)-4-[(2R)-2-methyl-1,4-oxazep…
| 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) | 1.04 | 1.77 | -44.37 | 4 | 5 | 1 | 69 | 258.386 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.04 | -0.15 | -7.55 | 3 | 5 | 0 | 68 | 257.378 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.04 | 2.81 | -118.37 | 5 | 5 | 2 | 73 | 259.394 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
