In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 6th, 2010 | 19 | Yes |
Popular Name: (1R,2S)-1-(4-chlorophenyl)-1-(4-fluorophenoxy)propan-2-amine (1R,2S)-1-(4-chlorophenyl)-1-(4-…
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) | 3.62 | 6.85 | -51.72 | 3 | 2 | 1 | 37 | 280.75 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.62 | 6.87 | -4.04 | 2 | 2 | 0 | 35 | 279.742 | 4 | ↓ |