| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2010 | 20 | Yes |
Popular Name: N-[[3-[[methyl(propyl)amino]methyl]benzothiophen-2-yl]methyl]cyclopropanamine N-[[3-[[methyl(propyl)amino]meth…
| 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) | 3.68 | 10.81 | -110.36 | 3 | 2 | 2 | 21 | 290.476 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.68 | 8.07 | -37.42 | 2 | 2 | 1 | 20 | 289.468 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.68 | 9.52 | -38.34 | 2 | 2 | 1 | 16 | 289.468 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
