| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2009 | 9 | Yes |
Popular Name: 3-(cyclopropylamino)-2-methylpropanenitrile 3-(cyclopropylamino)-2-methylpro…
Find On: PubMed — Wikipedia — Google
CAS Number: 1099649-53-2
| 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) | 0.99 | 4.09 | -46.51 | 2 | 2 | 1 | 40 | 125.195 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.99 | 2.93 | -4.8 | 1 | 2 | 0 | 36 | 124.187 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
No pre-computed analogs available. Try a structural similarity search.