| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2008 | 18 | Yes |
Popular Name: MFCD07379604 MFCD07379604
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1019350-83-4 , N/A
2-(Cyclohexyl(ethyl)amino)nicotinic acid
2-[Cyclohexyl(ethyl)amino]nicotinic 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) | 2.95 | 7.31 | -57.66 | 1 | 4 | 0 | 58 | 248.326 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.95 | 6.91 | -53.44 | 0 | 4 | -1 | 56 | 247.318 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
