| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2008 | 13 | Yes |
Popular Name: (3-methylpentan-2-yl)(thiophen-2-ylmethyl)amine (3-methylpentan-2-yl)(thiophen-2…
Find On: PubMed — Wikipedia — Google
CAS Number: 1042528-42-6
| 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) | 3.35 | 6.93 | -35.68 | 2 | 1 | 1 | 17 | 198.355 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.35 | 5.63 | -1.67 | 1 | 1 | 0 | 12 | 197.347 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
