| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2005 | 21 | Yes |
Popular Name: 2-benzyl-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridine 2-benzyl-1,2,3,4-tetrahydrobenzo…
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CAS Number: 1541-57-7
| 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) | 3.57 | 10.73 | -45.24 | 1 | 2 | 1 | 17 | 275.375 | 2 | ↓ |
| Mid Mid (pH 6-8) | 3.57 | 8.44 | -7.57 | 0 | 2 | 0 | 16 | 274.367 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 125 - 126 | KeyOrganics |
