| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2005 | 19 | No |
Popular Name: 2-(4-Methylpiperidin-1-yl)-3-nitrobenzoic acid 2-(4-Methylpiperidin-1-yl)-3-nit…
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CAS Numbers: , 890091-66-4
2-(4-Methyl-1-piperidinyl)-3-nitrobenzoic acid
2-(4-Methyl-piperidin-1-yl)-3-nitro-benzoic acid
2-(4-methylpiperidin-1-yl)-3-nitrobenzoicacid
| 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) | 3.14 | 0.47 | -44.73 | 0 | 6 | -1 | 89 | 263.273 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.