| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 14th, 2011 | 19 | Yes |
Popular Name: 4-[[methyl-[(5-propyl-1H-pyrazol-3-yl)methyl]amino]methyl]cyclohexanamine 4-[[methyl-[(5-propyl-1H-pyrazol…
| 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) | 1.84 | 6.29 | -92.05 | 5 | 4 | 2 | 61 | 266.433 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.84 | 4.25 | -44.32 | 4 | 4 | 1 | 60 | 265.425 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
