| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2008 | 11 | Yes |
Popular Name: 3-methyl-1-(thiophen-2-yl)butan-1-amine hydrochloride 3-methyl-1-(thiophen-2-yl)butan-…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1019444-13-3 , 1193390-55-4
| 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) | 0.98 | 4.38 | -42.45 | 3 | 1 | 1 | 28 | 170.301 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.98 | 4.09 | -1.53 | 2 | 1 | 0 | 26 | 169.293 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 329 - 331 | Enamine Building Blocks |
| MP | 329...331 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
