In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2009 | 24 | Yes |
Popular Name: (1S)-1-(4-ethoxy-3-methoxy-phenyl)-N-methyl-N-[2-(4-pyridyl)ethyl]ethane-1,2-diamine (1S)-1-(4-ethoxy-3-methoxy-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) | 1.27 | 5.15 | -52.9 | 3 | 5 | 1 | 62 | 330.452 | 9 | ↓ |
Mid Mid (pH 6-8) | 1.27 | 5.8 | -107.53 | 4 | 5 | 2 | 63 | 331.46 | 9 | ↓ |