| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2005 | 20 | No |
Popular Name: N-[4-(Methylsulfonyl)-2-nitrophenyl]piperidin-4-amine N-[4-(Methylsulfonyl)-2-nitrophe…
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CAS Numbers: 849035-94-5 , [849035-94-5]
METHYLSULFONYLNITROPHENYLPIPERIDINAMIN
| 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) | 1.04 | -5.37 | -60.06 | 3 | 7 | 1 | 108 | 300.36 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 178 - 179° | Fluorochem |
| Purity | 95%+ | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.