| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 2nd, 2008 | 9 | Yes |
Popular Name: 3-[isopropyl(methyl)amino]propanenitrile 3-[isopropyl(methyl)amino]propan…
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CAS Number: 89940-73-8
| 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) | 0.47 | 5.12 | -45.11 | 1 | 2 | 1 | 28 | 127.211 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.47 | 2.77 | -5.1 | 0 | 2 | 0 | 27 | 126.203 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
