In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2009 | 22 | Yes |
Popular Name: (1R)-N'-[(2-ethoxyphenyl)methyl]-N,N-dimethyl-1-phenyl-ethane-1,2-diamine (1R)-N'-[(2-ethoxyphenyl)methyl]…
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) | 3.49 | 8.95 | -33.3 | 2 | 3 | 1 | 26 | 299.438 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.49 | 6.75 | -3.67 | 1 | 3 | 0 | 24 | 298.43 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.49 | 8.11 | -36.12 | 2 | 3 | 1 | 29 | 299.438 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.49 | 10.35 | -122.01 | 3 | 3 | 2 | 30 | 300.446 | 8 | ↓ |