In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2010 | 20 | Yes |
Popular Name: N-[(1-thieno[3,2-c]pyridin-4-yl-4-piperidyl)methyl]propan-1-amine N-[(1-thieno[3,2-c]pyridin-4-yl-…
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) | 3.12 | 9.48 | -85.4 | 3 | 3 | 2 | 34 | 291.464 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.12 | 9 | -43.07 | 2 | 3 | 1 | 33 | 290.456 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.