In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 17 | Yes |
Popular Name: (2R)-2-(4-fluorophenyl)-2-[[(2S)-tetrahydrofuran-2-yl]methylamino]acetonitrile (2R)-2-(4-fluorophenyl)-2-[[(2S)…
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) | 2.00 | 4.79 | -9.48 | 1 | 3 | 0 | 45 | 234.274 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.00 | 5.95 | -50.61 | 2 | 3 | 1 | 50 | 235.282 | 4 | ↓ |