| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2010 | 14 | Yes |
Popular Name: (3S,6S)-6-methyl-1-[[(2S)-tetrahydrofuran-2-yl]methyl]piperidin-3-amine (3S,6S)-6-methyl-1-[[(2S)-tetrah…
| 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) | 0.31 | 1.22 | -41.97 | 3 | 3 | 1 | 40 | 199.318 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.31 | 3.11 | -27.81 | 3 | 3 | 1 | 40 | 199.318 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.31 | 3.44 | -105.84 | 4 | 3 | 2 | 41 | 200.326 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
