In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2011 | 16 | Yes |
Popular Name: 5-[(5-chloro-2-thienyl)methyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine 5-[(5-chloro-2-thienyl)methyl]-6…
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) | 3.71 | 9.36 | -42.37 | 1 | 1 | 1 | 4 | 270.83 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.71 | 7.16 | -4.31 | 0 | 1 | 0 | 3 | 269.822 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.