| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2008 | 11 | Yes |
Popular Name: 3-methyl-2-(propan-2-ylamino)butanoic acid hydrochloride 3-methyl-2-(propan-2-ylamino)but…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1396964-65-0 , 1396964-87-6
| 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) | -0.33 | 3.96 | -35.34 | 2 | 3 | 0 | 57 | 159.229 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 194 - 196 | Enamine Building Blocks |
| MP | 194...196 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| PUBCHEM_PATENT_ID | WO1999055688A1 | IBM Patent Data |
