In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 17 | Yes |
Popular Name: 2-butoxy-N-[(3-chloro-4-fluoro-phenyl)methyl]ethanamine 2-butoxy-N-[(3-chloro-4-fluoro-p…
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) | 3.69 | 7.51 | -45.86 | 2 | 2 | 1 | 26 | 260.76 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.69 | 6.15 | -3.71 | 1 | 2 | 0 | 21 | 259.752 | 8 | ↓ |