| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 16 | Yes |
Popular Name: [(4-chlorophenyl)methyl][2-(pyrrolidin-1-yl)ethyl]amine dihydrochloride [(4-chlorophenyl)methyl][2-(pyrr…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 105479-08-1 , 105479-11-6
| 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) | 2.61 | 8.24 | -121.54 | 3 | 2 | 2 | 21 | 240.778 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.61 | 6.74 | -35.75 | 2 | 2 | 1 | 16 | 239.77 | 5 | ↓ |
| 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.
