In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 18 | Yes |
Popular Name: N-[(3-chloro-4-fluoro-phenyl)methyl]-2-isopentyloxy-ethanamine N-[(3-chloro-4-fluoro-phenyl)met…
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) | 3.90 | 8.02 | -45.98 | 2 | 2 | 1 | 26 | 274.787 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.90 | 6.66 | -3.6 | 1 | 2 | 0 | 21 | 273.779 | 8 | ↓ |