| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2008 | 15 | Yes |
Popular Name: MFCD11132101 MFCD11132101
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1019349-74-6 , N/A
2-(Butyl(methyl)amino)isonicotinic acid
2-[Butyl(methyl)amino]isonicotinic 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) | 2.44 | 6.78 | -49.58 | 1 | 4 | 0 | 58 | 208.261 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.44 | 6.45 | -48.2 | 0 | 4 | -1 | 56 | 207.253 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
