| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2005 | 18 | No |
Popular Name: 5-Methyl-4-(4-nitro-pyrazol-1-ylmethyl)-isoxazole-3-carboxylic acid 5-Methyl-4-(4-nitro-pyrazol-1-yl…
Find On: PubMed — Wikipedia — Google
CAS Number: 956758-72-8
5-Methyl-4-(4-nitro-pyrazol-1-ylmethyl)-isoxazole-
5-methyl-4-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,2-oxazole-3-carboxylic acid
5-methyl-4-[(4-nitro-1H-pyrazol-1-yl)methyl]-3-isoxazolecarboxylic acid
5-Methyl-4-[(4-nitro-1H-pyrazol-1-yl)methyl]-isoxazole-3-carboxylic acid
5-methyl-4-[(4-nitro-1h-pyrazol-1-yl)methyl]-isoxazole-3-carboxylicacid
5-Methyl-4-[(4-nitro-1h-pyrazol-1-yl)methyl]isoxazole-3-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) | 0.31 | 2.29 | -51.94 | 0 | 9 | -1 | 129 | 251.178 | 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.