In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 20 | Yes |
Popular Name: (1S,2S)-1-(4-chloro-3-ethyl-phenoxy)-1-phenyl-propan-2-amine (1S,2S)-1-(4-chloro-3-ethyl-phen…
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) | 4.30 | 8.37 | -43.18 | 3 | 2 | 1 | 37 | 290.814 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.30 | 8.13 | -2.74 | 2 | 2 | 0 | 35 | 289.806 | 5 | ↓ |