In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 20 | Yes |
Popular Name: (1S)-1-(4-chloro-3-fluoro-phenyl)-N-isobutyl-N-(2-methoxyethyl)ethane-1,2-diamine (1S)-1-(4-chloro-3-fluoro-phenyl…
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) | 2.61 | 5.59 | -52.83 | 3 | 3 | 1 | 40 | 303.829 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.61 | 5.79 | -137.26 | 4 | 3 | 2 | 41 | 304.837 | 8 | ↓ |