| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2010 | 21 | Yes |
Popular Name: (2S)-1-(3,4-dimethylphenyl)-2-[methyl-[[(2S)-tetrahydropyran-2-yl]methyl]amino]propan-1-one (2S)-1-(3,4-dimethylphenyl)-2-[m…
| 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) | 3.53 | 10.2 | -32.96 | 1 | 3 | 1 | 31 | 290.427 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.53 | 7.43 | -8.58 | 0 | 3 | 0 | 30 | 289.419 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
