| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2008 | 14 | No |
Popular Name: [(3-methyl-4-nitro-1H-pyrazol-5-yl)thio]acetic acid [(3-methyl-4-nitro-1H-pyrazol-5-…
Find On: PubMed — Wikipedia — Google
CAS Numbers: , 879565-31-8 , [879565-31-8]
(5-Methyl-4-nitro-2 H -pyrazol-3-ylsulfanyl)-aceti
(5-Methyl-4-nitro-2 H -pyrazol-3-ylsulfanyl)-acetic acid
2-[(3-methyl-4-nitro-1H-pyrazol-5-yl)sulfanyl]acetic acid
acetic acid, [(3-methyl-4-nitro-1H-pyrazol-5-yl)thio]-
METHYLNITROPYRAZOLYLTHIOACETICACI
| 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) | 0.40 | 3.16 | -42.25 | 1 | 7 | -1 | 115 | 216.198 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Warnings | IRRITANT | Matrix Scientific |
