| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 15th, 2012 | 25 | No |
Popular Name: N-[(1S)-1-(benzothiophen-3-yl)ethyl]-N'-(4-cyanophenyl)oxamide N-[(1S)-1-(benzothiophen-3-yl)et…
| 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) | 2.83 | 7.5 | -10.01 | 2 | 5 | 0 | 82 | 349.415 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.02 | 6.7 | -41.54 | 1 | 5 | -1 | 88 | 348.407 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.