In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 24th, 2011 | 20 | Yes |
Popular Name: N-[(4-bromo-2-thienyl)methyl]-4-(1-piperidyl)aniline N-[(4-bromo-2-thienyl)methyl]-4-…
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) | 4.84 | 9.85 | -29.68 | 2 | 2 | 1 | 16 | 352.321 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.84 | 9.2 | -3.15 | 1 | 2 | 0 | 15 | 351.313 | 4 | ↓ |