| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2011 | 17 | Yes |
Popular Name: [(2R)-2-methyl-1,4-oxazepan-4-yl]-[(2S,5S)-5-methylpiperazin-2-yl]methanone [(2R)-2-methyl-1,4-oxazepan-4-yl…
| 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) | -0.11 | 1.33 | -47.61 | 3 | 5 | 1 | 58 | 242.343 | 1 | ↓ |
| Hi High (pH 8-9.5) | -0.11 | 0.06 | -7.52 | 2 | 5 | 0 | 54 | 241.335 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
