| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2008 | 14 | Yes |
Popular Name: 2-(tert-butylamino)nicotinic acid 2-(tert-butylamino)nicotinic acid
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CAS Numbers: 460044-25-1 , [460044-25-1]
2-(tert-butylamino)nicotinicacid
3-Pyridinecarboxylic acid, 2-[(1,1-dimethylethyl)amino]- (9CI)
| 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) | 1.61 | 5.09 | -42.93 | 2 | 4 | 0 | 66 | 194.234 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.61 | 5.02 | -47.08 | 1 | 4 | -1 | 65 | 193.226 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
