In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 4th, 2009 | 19 | No |
Popular Name: (2-amino-4,5,6,7-tetrahydrothieno[5,4-c]pyridin-3-yl)-(4-bromophenyl)methanone (2-amino-4,5,6,7-tetrahydrothien…
None
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) | 3.16 | 5.69 | -48.73 | 4 | 3 | 1 | 60 | 338.25 | 2 | ↓ |
Hi High (pH 8-9.5) | 3.16 | 4.26 | -7.82 | 3 | 3 | 0 | 55 | 337.242 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.