In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 9th, 2011 | 23 | Yes |
Popular Name: (1S)-2-[[(1R)-1-methyl-2-phenyl-ethyl]amino]-1-[4-(trifluoromethyl)phenyl]ethanol (1S)-2-[[(1R)-1-methyl-2-phenyl-…
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) | 3.94 | 8.26 | -45.06 | 3 | 2 | 1 | 37 | 324.366 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.94 | 7.18 | -4.8 | 2 | 2 | 0 | 32 | 323.358 | 7 | ↓ |