| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 13th, 2008 | 12 | Yes |
Popular Name: 2-amino-2-(3,4-difluorophenyl)acetonitrile 2-amino-2-(3,4-difluorophenyl)ac…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1193388-75-8 , 218449-30-0
| 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) | -0.53 | 2.69 | -11.13 | 2 | 2 | 0 | 50 | 168.146 | 1 | ↓ |
| Lo Low (pH 4.5-6) | -0.53 | 2.99 | -65.69 | 3 | 2 | 1 | 51 | 169.154 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 172 - 174 | Enamine Building Blocks |
| MP | 172...174 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
