In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2010 | 20 | Yes |
Popular Name: N,1-dimethyl-N-[[(2S,5S)-5-(propylaminomethyl)tetrahydrofuran-2-yl]methyl]piperidin-4-amine N,1-dimethyl-N-[[(2S,5S)-5-(prop…
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) | 1.44 | 8.73 | -168.92 | 4 | 4 | 3 | 35 | 286.484 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.44 | 6.32 | -79.02 | 3 | 4 | 2 | 34 | 285.476 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.