| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 15th, 2008 | 16 | Yes |
Popular Name: 2-(1,4-diazepan-1-yl)-1,3-benzoxazole trifluoroacetate 2-(1,4-diazepan-1-yl)-1,3-benzox…
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CAS Numbers: , 159731-55-2 , 956317-44-5
2-(1,4-diazepan-1-yl)-1,3-benzoxazole
2-(1,4-Diazepan-1-yl)-1,3-benzoxazole trifluoroacetic acid salt
2-(1,4-Diazepan-1-yl)-1,3-benzoxazoletrifluoroacetic acid salt
2-(1,4-Diazepan-1-yl)benzo[d]oxazole
2-[1,4]Diazepan-1-yl-benzooxazole
benzoxazole, 2-(hexahydro-1H-1,4-diazepin-1-yl)-, trifluoroacetate (1:1)
| 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) | 1.52 | 2.01 | -44.31 | 2 | 4 | 1 | 46 | 218.28 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
