| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2004 | 17 | No |
Popular Name: 5-[(4-Chloro-3-nitro-1H-pyrazol-1-yl)methyl]-2-furaldehyde 5-[(4-Chloro-3-nitro-1H-pyrazol-…
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CAS Numbers: , 512809-42-6
5-(4-Chloro-3-nitro-pyrazol-1-ylmethyl)-furan-2-ca
5-(4-Chloro-3-nitro-pyrazol-1-ylmethyl)-furan-2-carbaldehyde
5-({4-chloro-3-nitro-1H-pyrazol-1-yl}methyl)-2-furaldehyde
5-[(4-chloro-3-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) | 1.96 | 2.89 | -18.02 | 0 | 7 | 0 | 93 | 255.617 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.