| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 8th, 2011 | 21 | Yes |
Popular Name: (4S)-N-[(1S)-2-(2,6-difluorophenyl)-1-methyl-ethyl]-4,5,6,7-tetrahydrobenzothiophen-4-amine (4S)-N-[(1S)-2-(2,6-difluorophen…
| 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) | 3.55 | 9.44 | -4.26 | 1 | 1 | 0 | 12 | 307.409 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.55 | 10.48 | -31.31 | 2 | 1 | 1 | 17 | 308.417 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
