| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2010 | 18 | Yes |
Popular Name: (1S)-1-(4-bromophenyl)-N-[(4,5-dimethyloxazol-2-yl)methyl]ethanamine (1S)-1-(4-bromophenyl)-N-[(4,5-d…
| 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) | 3.23 | 5.62 | -44.33 | 2 | 3 | 1 | 43 | 310.215 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.23 | 4.5 | -6.95 | 1 | 3 | 0 | 38 | 309.207 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
