In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 18 | Yes |
Popular Name: N-[[5-(4-bromo-2-fluoro-phenyl)-2-thienyl]methyl]propan-2-amine N-[[5-(4-bromo-2-fluoro-phenyl)-…
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) | 4.89 | 9.43 | -38.83 | 2 | 1 | 1 | 17 | 329.258 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.89 | 8.21 | -3.42 | 1 | 1 | 0 | 12 | 328.25 | 4 | ↓ |