In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 6th, 2010 | 20 | Yes |
Popular Name: (1S,2R)-1-(4-chlorophenyl)-1-(4-fluorophenoxy)butan-2-amine (1S,2R)-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) | 4.16 | 7.62 | -51.26 | 3 | 2 | 1 | 37 | 294.777 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.16 | 7.3 | -3.19 | 2 | 2 | 0 | 35 | 293.769 | 5 | ↓ |