| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 14th, 2012 | 13 | Yes |
Popular Name: 7-Methyl-2,3,4,5-tetrahydro-1H-benzo[b]azepin-5-amine dihydrochloride 7-Methyl-2,3,4,5-tetrahydro-1H-b…
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CAS Numbers: 1416354-44-3 , 886367-51-7 , N/A , [886367-51-7]
7-Methyl-2,3,4,5-tetrahydro-1H-benzo[b]azepin-5-amine
7-Methyl-2,3,4,5-tetrahydro-1H-benzo[b]azepin-5-aminedihydrochloride
| 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) | 0.06 | 3.56 | -42.39 | 4 | 2 | 1 | 40 | 177.271 | 0 | ↓ |
| Lo Low (pH 4.5-6) | 0.06 | 4.1 | -110.72 | 5 | 2 | 2 | 44 | 178.279 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.