In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 16 | Yes |
Popular Name: N-[(5-bromo-2-thienyl)methyl]-N-methyl-1-(3-pyridyl)methanamine N-[(5-bromo-2-thienyl)methyl]-N-…
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) | 2.73 | 5.79 | -5.62 | 0 | 2 | 0 | 16 | 297.221 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.73 | 8.12 | -45.68 | 1 | 2 | 1 | 17 | 298.229 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.