| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 21 | Yes |
Popular Name: 1-[4-[(1-isopropylpyrazol-4-yl)methyl]-1,4-diazepan-1-yl]-2-methoxy-ethanone 1-[4-[(1-isopropylpyrazol-4-yl)m…
| 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) | 0.32 | 7.64 | -48.74 | 1 | 6 | 1 | 52 | 295.407 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.32 | 5.8 | -15.31 | 0 | 6 | 0 | 51 | 294.399 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
