In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 21 | Yes |
Popular Name: (1S)-2-(3,4-dimethylphenyl)-1-(2-fluoro-4-methoxy-phenyl)-N-methyl-ethanamine (1S)-2-(3,4-dimethylphenyl)-1-(2…
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) | 4.46 | 9.2 | -40.67 | 2 | 2 | 1 | 26 | 288.386 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.46 | 8.28 | -4.92 | 1 | 2 | 0 | 21 | 287.378 | 5 | ↓ |