| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2009 | 19 | Yes |
Popular Name: 2-(Pyrrolidin-1-yl)-1-(p-tolyl)hexan-1-one 2-(Pyrrolidin-1-yl)-1-(p-tolyl)h…
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CAS Numbers: 1391052-36-0 , 34138-58-4
4'-methyl-.alpha.-Pyrrolidinohexanophenone (hydrochloride)
| 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) | 4.27 | 10.97 | -34.96 | 1 | 2 | 1 | 22 | 260.401 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.27 | 9.1 | -6.94 | 0 | 2 | 0 | 20 | 259.393 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.