In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 20 | Yes |
Popular Name: (1R)-2-(4-chloro-2-methyl-phenoxy)-1-(4-methoxyphenyl)ethanamine (1R)-2-(4-chloro-2-methyl-phenox…
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) | 2.22 | 6.46 | -52.14 | 3 | 3 | 1 | 46 | 292.786 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.22 | 6.06 | -5.57 | 2 | 3 | 0 | 44 | 291.778 | 5 | ↓ |