| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 30th, 2007 | 33 | No |
Popular Name: 4-methoxy-N-({[(4-methylbenzyl)oxy]imino}methyl)-2-[3-(trifluoromethyl)phenoxy]nicotinamide 4-methoxy-N-({[(4-methylbenzyl)o…
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CAS Number: 478262-36-1
| 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) | 4.65 | 10.2 | -19.99 | 1 | 7 | 0 | 82 | 459.424 | 9 | ↓ |
| Hi High (pH 8-9.5) | 4.72 | 7.72 | -59.9 | 0 | 7 | -1 | 88 | 458.416 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.65 | 3.53 | -47.84 | 2 | 7 | 1 | 83 | 460.432 | 9 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 132 - 134 | KeyOrganics |
