| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 10th, 2009 | 20 | Yes |
Popular Name: (S)-(2-bromophenyl)-(3,5-dimethylbenzofuran-2-yl)methanamine (S)-(2-bromophenyl)-(3,5-dimethy…
| 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) | 5.03 | 8.35 | -44.33 | 3 | 2 | 1 | 41 | 331.233 | 2 | ↓ |
| Hi High (pH 8-9.5) | 5.03 | 8.04 | -5.97 | 2 | 2 | 0 | 39 | 330.225 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
