| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2010 | 21 | No |
Popular Name: 2-[methyl-[[(2R)-tetrahydropyran-2-yl]methyl]amino]-1-(4-nitrophenyl)ethanone 2-[methyl-[[(2R)-tetrahydropyran…
| 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) | 2.33 | 9.05 | -52.05 | 1 | 6 | 1 | 77 | 293.343 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.33 | 6.74 | -11.06 | 0 | 6 | 0 | 75 | 292.335 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
