| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2005 | 18 | Yes |
Popular Name: 2-[(4,6-Dimethylpyrimidin-2-yl)amino]benzoic acid 2-[(4,6-Dimethylpyrimidin-2-yl)a…
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CAS Numbers: 17174-03-7 , [17174-03-7] , [18159-99-4]
2-((4,6-Dimethylpyrimidin-2-yl)amino)benzoic acid
2-((4,6-Dimethylpyrimidin-2-yl)amino)benzoicacid
2-(4,6-Dimethyl-pyrimidin-2-ylamino)-benzoic acid hydrochloride
2-(4,6-dimethyl-pyrimidin-2-ylamino)-benzoicacidhydrochloride
DIMETHYLPYRIMIDINYLAMINOBENZOICACI
| 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) | 3.03 | 0.12 | -58.24 | 1 | 5 | -1 | 77 | 242.258 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 252 - 254° (de | Fluorochem |
| MP | 252-254° | Matrix Scientific |
| MP | 252-254° (dec.) | Oakwood Chemical |
| Purity | 95% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
| PUBCHEM_PATENT_ID | WO2000001692A1 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.