In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 17th, 2009 | 19 | Yes |
Popular Name: (2S)-1-(dimethylamino)-3-[4-(trifluoromethoxy)anilino]propan-2-ol (2S)-1-(dimethylamino)-3-[4-(tri…
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) | 2.15 | 2.79 | -40.69 | 3 | 4 | 1 | 46 | 279.282 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.15 | 0.33 | -4.6 | 2 | 4 | 0 | 45 | 278.274 | 7 | ↓ |