In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 3rd, 2010 | 21 | Yes |
Popular Name: 1-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-[[(1R)-1-(2-thienyl)propyl]amino]ethanone 1-(6,7-dihydro-4H-thieno[3,2-c]p…
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) | 3.08 | 8.69 | -40.02 | 2 | 3 | 1 | 37 | 321.491 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.08 | 7.3 | -10.28 | 1 | 3 | 0 | 32 | 320.483 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.