| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 26 | Yes |
Popular Name: (7S)-7-phenyl-1-[(3-phenylisoxazol-5-yl)methyl]-1,4-diazepan-5-one (7S)-7-phenyl-1-[(3-phenylisoxaz…
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| 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) | 2.96 | 7.32 | -11.87 | 1 | 5 | 0 | 58 | 347.418 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.96 | 9.09 | -50.9 | 2 | 5 | 1 | 60 | 348.426 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![7-phenyl-1-[(3-phenylisoxazol-5-yl)methyl]-1,4-diazepan-5-one](http://zinc12.docking.org/img/rings/26490.gif)