In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2010 | 20 | Yes |
Popular Name: N-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]pyridine-4-carboxamide N-[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) | 1.14 | 6.3 | -52.12 | 2 | 4 | 1 | 46 | 288.396 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.14 | 4.13 | -11.68 | 1 | 4 | 0 | 45 | 287.388 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.