| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 4th, 2011 | 24 | No |
Popular Name: (4-tert-butyl-1,4-diazepan-1-yl)-[(5R)-5-phenyl-4,5-dihydroisoxazol-3-yl]methanone (4-tert-butyl-1,4-diazepan-1-yl)…
None
| 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) | 2.62 | 9.82 | -35.72 | 1 | 5 | 1 | 46 | 330.452 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.62 | 8.17 | -5.93 | 0 | 5 | 0 | 45 | 329.444 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
