In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2009 | 16 | Yes |
Popular Name: 1-(4-bromo-2-fluoro-phenyl)-N-[[(2S)-tetrahydrofuran-2-yl]methyl]methanamine 1-(4-bromo-2-fluoro-phenyl)-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) | 2.77 | 6.29 | -40.24 | 2 | 2 | 1 | 26 | 289.168 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.77 | 4.83 | -5.62 | 1 | 2 | 0 | 21 | 288.16 | 4 | ↓ |