| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 8th, 2011 | 18 | Yes |
Popular Name: (4R)-4-(cyclohexylamino)-6,7-dihydro-5H-benzothiophene-4-carbonitrile (4R)-4-(cyclohexylamino)-6,7-dih…
| 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) | 3.85 | 7.18 | -6.14 | 1 | 2 | 0 | 36 | 260.406 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 3.85 | 7.95 | -40.45 | 2 | 2 | 1 | 40 | 261.414 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
