In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2009 | 23 | Yes |
Popular Name: 2-[2-[(benzylamino)methyl]-6-methoxy-phenoxy]-N,N-dimethyl-ethanamine 2-[2-[(benzylamino)methyl]-6-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) | 2.75 | 10.19 | -117.29 | 3 | 4 | 2 | 40 | 316.445 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.75 | 8.77 | -40.13 | 2 | 4 | 1 | 35 | 315.437 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.75 | 6.2 | -5.02 | 1 | 4 | 0 | 34 | 314.429 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.75 | 7.61 | -38.72 | 2 | 4 | 1 | 38 | 315.437 | 9 | ↓ |