In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 13th, 2010 | 19 | Yes |
Popular Name: N'-[(2-bromo-4,5-dimethoxy-phenyl)methyl]-N-ethyl-N-methyl-ethane-1,2-diamine N'-[(2-bromo-4,5-dimethoxy-pheny…
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) | 2.29 | 6.99 | -115.64 | 3 | 4 | 2 | 40 | 333.27 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.29 | 3.28 | -5.02 | 1 | 4 | 0 | 34 | 331.254 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.29 | 5.61 | -37 | 2 | 4 | 1 | 35 | 332.262 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.29 | 4.67 | -40.82 | 2 | 4 | 1 | 38 | 332.262 | 8 | ↓ |