| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 8th, 2011 | 15 | Yes |
Popular Name: (4S)-4-(cyclopropylamino)-6,7-dihydro-5H-benzothiophene-4-carbonitrile (4S)-4-(cyclopropylamino)-6,7-di…
| 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) | 2.31 | 5.34 | -5.06 | 1 | 2 | 0 | 36 | 218.325 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.31 | 6.47 | -38.25 | 2 | 2 | 1 | 40 | 219.333 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
