In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 16 | Yes |
Popular Name: (2S)-2-[[(2R)-2-(4-fluorophenyl)-2-hydroxy-ethyl]amino]butan-1-ol (2S)-2-[[(2R)-2-(4-fluorophenyl)…
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) | 1.31 | 1.21 | -41.49 | 4 | 3 | 1 | 57 | 228.287 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.31 | 0.19 | -5.31 | 3 | 3 | 0 | 52 | 227.279 | 6 | ↓ |