| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2008 | 13 | Yes |
Popular Name: 1-Amino-4,5-dihydro-1H-benzo[d]azepin-2(3H)-one 1-Amino-4,5-dihydro-1H-benzo[d]a…
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CAS Numbers: 253185-43-2 , N/A , no cas , [253185-43-2]
1-Amino-1,3,4,5-tetrahydro-benzo[d]azepin-2-one
1-amino-1,3,4,5-tetrahydrobenzo[d]azepin-2-one
1-Amino-4,5-dihydro-1H-benzo[d]azepin-2(3H)-one hydrobromide
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) | -1.47 | 0.91 | -47.27 | 4 | 3 | 1 | 57 | 177.227 | 0 | ↓ |
| Mid Mid (pH 6-8) | -1.47 | 0.56 | -10.62 | 3 | 3 | 0 | 55 | 176.219 | 0 | ↓ |
No pre-computed analogs available. Try a structural similarity search.