In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 19 | Yes |
Popular Name: (2S)-1-tert-butoxy-3-[(3-chloro-4-fluoro-phenyl)methylamino]propan-2-ol (2S)-1-tert-butoxy-3-[(3-chloro-…
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) | 2.79 | 4.75 | -52.34 | 3 | 3 | 1 | 46 | 290.786 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.79 | 3.34 | -7.19 | 2 | 3 | 0 | 41 | 289.778 | 7 | ↓ |