In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2011 | 21 | Yes |
Popular Name: 2-[4-(2-aminoethyl)-1-piperidyl]-1-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethanone 2-[4-(2-aminoethyl)-1-piperidyl]…
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) | 0.99 | 6.92 | -101.22 | 4 | 4 | 2 | 52 | 309.479 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.99 | 4.75 | -49.39 | 3 | 4 | 1 | 51 | 308.471 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.