| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2010 | 19 | Yes |
Popular Name: 1-(4-methylsulfanylphenyl)-2-[methyl-[[(2S)-tetrahydrofuran-2-yl]methyl]amino]ethanone 1-(4-methylsulfanylphenyl)-2-[me…
| 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) | 2.30 | 8.52 | -40.93 | 1 | 3 | 1 | 31 | 280.413 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.30 | 6.16 | -9.53 | 0 | 3 | 0 | 30 | 279.405 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
