In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 20 | Yes |
Popular Name: (1R)-N-butyl-1-(2,5-dimethoxyphenyl)-N-ethyl-ethane-1,2-diamine (1R)-N-butyl-1-(2,5-dimethoxyphe…
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) | 1.31 | 6.23 | -31.21 | 3 | 4 | 1 | 49 | 281.42 | 9 | ↓ |
Mid Mid (pH 6-8) | 1.31 | 6.34 | -122.63 | 4 | 4 | 2 | 51 | 282.428 | 9 | ↓ |