| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2011 | 20 | Yes |
Popular Name: 2-[4-[[1-[(1S)-1-methylpropyl]pyrazol-3-yl]methyl]-1,4-diazepan-1-yl]ethanol 2-[4-[[1-[(1S)-1-methylpropyl]py…
| 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) | 1.20 | 3.98 | -33.34 | 2 | 5 | 1 | 46 | 281.424 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.20 | 6.1 | -103.55 | 3 | 5 | 2 | 47 | 282.432 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
