In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2010 | 18 | Yes |
Popular Name: (2S)-1-ethoxy-N-[(1R)-1-(2,3,4-trichlorophenyl)ethyl]propan-2-amine (2S)-1-ethoxy-N-[(1R)-1-(2,3,4-t…
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) | 4.64 | 8 | -40.75 | 2 | 2 | 1 | 26 | 311.66 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.64 | 7.07 | -2.38 | 1 | 2 | 0 | 21 | 310.652 | 6 | ↓ |