| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 24th, 2009 | 12 | Yes |
Popular Name: 2-ethyl-2-methylheptanoic acid 2-ethyl-2-methylheptanoic acid
Find On: PubMed — Wikipedia — Google
CAS Number: 31080-38-3
| 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) | 3.50 | 7.53 | -47.18 | 0 | 2 | -1 | 40 | 171.26 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.50 | 5.56 | -4.84 | 1 | 2 | 0 | 37 | 172.268 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
