| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2005 | 19 | No |
Popular Name: 2-((5,5-Dimethyl-3-oxocyclohex-1-enyl)amino)benzoic acid 2-((5,5-Dimethyl-3-oxocyclohex-1…
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CAS Numbers: 731785-06-1 , [731785-06-1]
2-((5,5-Dimethyl-3-oxocyclohex-1-enyl)amino)
2-[(5,5-dimethyl-3-oxo-1-cyclohexenyl)amino]benzenecarboxylic acid
2-[(5,5-Dimethyl-3-oxocyclohex-1-en-1-yl)amino]benzoic 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) | 3.20 | 0.86 | -62.71 | 1 | 4 | -1 | 69 | 258.297 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.