| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2004 | 17 | No |
Popular Name: 5-[(4-nitro-1H-pyrazol-1-yl)methyl]-2-furoic acid 5-[(4-nitro-1H-pyrazol-1-yl)meth…
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CAS Numbers: , 436086-87-2 , [436086-87-2]
2-Furancarboxylic acid,5-[(4-nitro-1H-pyrazol-1-yl)methyl]-
5-(4-Nitro-pyrazol-1-ylmethyl)-furan-2-carboxylic
5-(4-Nitro-pyrazol-1-ylmethyl)-furan-2-carboxylic acid
5-(4-Nitro-pyrazol-1-ylmethyl)-furan-2-carboxylicacid
5-({4-nitro-1H-pyrazol-1-yl}methyl)-2-furoic acid
5-({4-[hydroxy(oxido)amino]-1H-pyrazol-1-yl}methyl)-2-furoic acid
5-[(4-nitro-1H-pyrazol-1-yl)methyl]furan-2-carboxylic acid
| 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) | 0.94 | 4.79 | -54.76 | 0 | 8 | -1 | 117 | 236.163 | 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.