| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 26th, 2010 | 18 | Yes |
Popular Name: 1-[(4-chloropyrazol-1-yl)methyl]-4-methylsulfonyl-1,4-diazepane 1-[(4-chloropyrazol-1-yl)methyl]…
| 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) | 0.55 | 1.88 | -13.78 | 0 | 6 | 0 | 58 | 292.792 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.55 | 3.94 | -50.37 | 1 | 6 | 1 | 60 | 293.8 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
