| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2009 | 19 | Yes |
Popular Name: N-[(1,3,5-trimethylpyrazol-4-yl)methyl]benzothiophen-5-amine N-[(1,3,5-trimethylpyrazol-4-yl)…
| 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) | 2.96 | 7.17 | -8.39 | 1 | 3 | 0 | 30 | 271.389 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.96 | 7.3 | -33.12 | 2 | 3 | 1 | 31 | 272.397 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
