| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2010 | 20 | Yes |
Popular Name: N-[[3-[(4-chloropyrazol-1-yl)methyl]benzothiophen-2-yl]methyl]ethanamine N-[[3-[(4-chloropyrazol-1-yl)met…
| 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) | 3.66 | 8.83 | -41.92 | 2 | 3 | 1 | 34 | 306.842 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.66 | 7.44 | -6.19 | 1 | 3 | 0 | 30 | 305.834 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
