| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2011 | 21 | No |
Popular Name: 2-[4-(2-aminoethyl)-1-piperidyl]-N-[(3R)-1,1-dioxothiolan-3-yl]-N-methyl-acetamide 2-[4-(2-aminoethyl)-1-piperidyl]…
| 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) | -0.76 | 2.33 | -112.25 | 4 | 6 | 2 | 87 | 319.471 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.76 | 0.14 | -58.6 | 3 | 6 | 1 | 85 | 318.463 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
