| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2011 | 18 | Yes |
Popular Name: 2-[1-[(4S)-4,5,6,7-tetrahydrobenzothiophen-4-yl]-4-piperidyl]ethanamine 2-[1-[(4S)-4,5,6,7-tetrahydroben…
| 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) | 2.36 | 7.4 | -95.97 | 4 | 2 | 2 | 32 | 266.454 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.36 | 5.43 | -44.09 | 3 | 2 | 1 | 31 | 265.446 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
