| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 15th, 2011 | 21 | Yes |
Popular Name: 2-[4-[(1R)-1-aminoethyl]-N-benzyl-2-bromo-anilino]ethanol 2-[4-[(1R)-1-aminoethyl]-N-benzy…
| 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) | 1.41 | 6.46 | -48.01 | 4 | 3 | 1 | 51 | 350.28 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.41 | 6.13 | -3.52 | 3 | 3 | 0 | 49 | 349.272 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
