| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 29th, 2008 | 22 | No |
Popular Name: 4-methoxy-N-[(methoxyimino)methyl]-2-phenoxynicotinamide 4-methoxy-N-[(methoxyimino)methy…
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CAS Number: 478262-46-3
| 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) | 1.73 | 3.29 | -17.2 | 1 | 7 | 0 | 82 | 301.302 | 6 | ↓ |
| Ref Reference (pH 7) | 1.73 | 4.52 | -18.51 | 1 | 7 | 0 | 82 | 301.302 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.80 | 2.04 | -59.88 | 0 | 7 | -1 | 88 | 300.294 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.73 | 2.93 | -56.93 | 0 | 7 | -1 | 84 | 300.294 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.73 | 3.49 | -58.23 | 0 | 7 | -1 | 84 | 300.294 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 146 - 149 | KeyOrganics |
