| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2011 | 23 | Yes |
Popular Name: [(6S)-6-tert-butyl-4,5,6,7-tetrahydrobenzothiophen-3-yl]-(4-ethylpiperazin-1-yl)methanone [(6S)-6-tert-butyl-4,5,6,7-tetra…
| 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) | 3.74 | 8.37 | -7.92 | 0 | 3 | 0 | 24 | 334.529 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.74 | 10.59 | -41.41 | 1 | 3 | 1 | 25 | 335.537 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
