In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 16 | Yes |
Popular Name: (1S,2S)-N1-ethyl-1-(4-fluorophenyl)-N1-methyl-butane-1,2-diamine (1S,2S)-N1-ethyl-1-(4-fluorophen…
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) | 2.21 | 4.99 | -43.72 | 3 | 2 | 1 | 31 | 225.331 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.21 | 6.16 | -36.78 | 3 | 2 | 1 | 30 | 225.331 | 5 | ↓ |