| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2005 | 19 | Yes |
Popular Name: 1-(3,4-dichlorobenzyl)-6-oxo-1,6-dihydro-3-pyridinecarboxylic acid 1-(3,4-dichlorobenzyl)-6-oxo-1,6…
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CAS Numbers: 338755-21-8 , [338755-21-8]
1-(3,4-dichlorobenzyl)-6-oxo-1,6-dihydro-3-pyridinecarboxylicacid
1-(3,4-Dichlorobenzyl)-6-oxo-1,6-dihydropyridine-3-carboxylic acid
| 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) | 3.05 | 0.9 | -44.53 | 0 | 4 | -1 | 62 | 297.117 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 253 - 257 | KeyOrganics |
| MP | 253-256.5° | Matrix Scientific |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.