In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 17 | Yes |
Popular Name: (1S,2R)-N1,N1-diethyl-1-(4-fluorophenyl)butane-1,2-diamine (1S,2R)-N1,N1-diethyl-1-(4-fluor…
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) | 2.58 | 5.07 | -42.78 | 3 | 2 | 1 | 31 | 239.358 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.58 | 6.06 | -33.59 | 3 | 2 | 1 | 30 | 239.358 | 6 | ↓ |