In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2010 | 20 | Yes |
Popular Name: 3-[[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-oxo-ethyl]amino]-N,N-dimethyl-propanamide 3-[[2-(6,7-dihydro-4H-thieno[3,2…
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) | -0.46 | 5.44 | -49.58 | 2 | 5 | 1 | 57 | 296.416 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.46 | 4.06 | -12.33 | 1 | 5 | 0 | 53 | 295.408 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.