| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 17 | Yes |
Popular Name: MFCD11618680 MFCD11618680
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1094711-00-8 , N/A
2-(2-Ethyl-1-piperidinyl)isonicotinic acid
2-(2-ethyl-1-piperidinyl)isonicotinicacid
| 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) | 2.78 | 7.8 | -41.79 | 1 | 4 | 0 | 58 | 234.299 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.78 | 7.32 | -46.22 | 0 | 4 | -1 | 56 | 233.291 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
