| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2010 | 19 | Yes |
Popular Name: N-[[3-(dimethylaminomethyl)-4-fluoro-benzothiophen-2-yl]methyl]cyclopropanamine N-[[3-(dimethylaminomethyl)-4-fl…
| 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) | 2.92 | 9.21 | -105.33 | 3 | 2 | 2 | 21 | 280.412 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.92 | 7.93 | -32.98 | 2 | 2 | 1 | 16 | 279.404 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.92 | 6.47 | -35.45 | 2 | 2 | 1 | 20 | 279.404 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
