In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 21 | Yes |
Popular Name: (2S)-1-(diethylamino)-3-[[3-(trifluoromethyl)phenyl]methylamino]propan-2-ol (2S)-1-(diethylamino)-3-[[3-(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) | 2.51 | 6.6 | -111.59 | 4 | 3 | 2 | 41 | 306.372 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.51 | 7.12 | -48.47 | 3 | 3 | 1 | 44 | 305.364 | 9 | ↓ |