| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2004 | 18 | No |
Popular Name: 5-(3,5-Dimethyl-4-nitro-pyrazol-1-ylmethyl)-furan-2-carbaldehyde 5-(3,5-Dimethyl-4-nitro-pyrazol-…
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CAS Number: 512809-77-7
5-(3,5-Dimethyl-4-nitro-pyrazol-1-ylmethyl)-furan-
5-({4-nitro-3,5-dimethyl-1H-pyrazol-1-yl}methyl)-2-furaldehyde
5-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]furan-2-carbaldehyde
| 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) | 1.60 | 6.49 | -18.8 | 0 | 7 | 0 | 94 | 249.226 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
No pre-computed analogs available. Try a structural similarity search.