| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2009 | 21 | Yes |
Popular Name: 2-(4-{2-[4-(2-aminoethyl)phenoxy]ethyl}piperazin-1-yl)ethan-1-ol 2-(4-{2-[4-(2-aminoethyl)phenoxy…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1157004-09-5 , 1427378-91-3
| 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) | 0.27 | 1.77 | -88.18 | 5 | 5 | 2 | 65 | 295.427 | 8 | ↓ |
| Mid Mid (pH 6-8) | 0.27 | -0.47 | -49.58 | 4 | 5 | 1 | 64 | 294.419 | 8 | ↓ |
| Mid Mid (pH 6-8) | 0.27 | 1.86 | -84.11 | 5 | 5 | 2 | 65 | 295.427 | 8 | ↓ |
| 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.
