| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 15th, 2011 | 19 | Yes |
Popular Name: 4-[(1R)-1-aminoethyl]-2-bromo-N-methyl-N-[(2-methylthiazol-4-yl)methyl]aniline 4-[(1R)-1-aminoethyl]-2-bromo-N-…
| 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) | 0.92 | 6.74 | -48.33 | 3 | 3 | 1 | 44 | 341.298 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.92 | 6.44 | -4.37 | 2 | 3 | 0 | 42 | 340.29 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
