In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2011 | 19 | Yes |
Popular Name: 2-[4-(2-aminoethyl)-1-piperidyl]-N-[[(2S)-tetrahydrofuran-2-yl]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) | 0.36 | 2.8 | -95.59 | 5 | 5 | 2 | 70 | 271.405 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.36 | 0.63 | -48.64 | 4 | 5 | 1 | 69 | 270.397 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.