In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2010 | 19 | Yes |
Popular Name: N-[[(2S,5S)-5-(ethylaminomethyl)tetrahydrofuran-2-yl]methyl]-N,1-dimethyl-piperidin-4-amine N-[[(2S,5S)-5-(ethylaminomethyl)…
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) | 0.93 | 7.98 | -166.92 | 4 | 4 | 3 | 35 | 272.457 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.93 | 5.57 | -77.95 | 3 | 4 | 2 | 34 | 271.449 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.