| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 8th, 2011 | 20 | Yes |
Popular Name: (4S)-N-[2-(3-methylphenoxy)ethyl]-4,5,6,7-tetrahydrobenzothiophen-4-amine (4S)-N-[2-(3-methylphenoxy)ethyl…
| 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) | 3.29 | 9.29 | -41.5 | 2 | 2 | 1 | 26 | 288.436 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.29 | 8.2 | -4.45 | 1 | 2 | 0 | 21 | 287.428 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
