In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 30th, 2006 | 12 | Yes |
Popular Name: 2,3,4,5-Tetrahydrobenzo[b]oxepin-5-ol 2,3,4,5-Tetrahydrobenzo[b]oxepin…
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CAS Numbers: 1423040-69-0 , 20426-87-3 , [20426-87-3]
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) | 1.54 | -1.29 | -4.68 | 1 | 2 | 0 | 29 | 164.204 | 0 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 89 - 91 | Enamine Building Blocks |
MP | 89...91 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |