In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 20 | Yes |
Popular Name: N-[2-fluoro-4-(methylaminomethyl)phenyl]-N-isobutyl-N',N'-dimethyl-ethane-1,2-diamine N-[2-fluoro-4-(methylaminomethyl…
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) | 2.84 | 9.65 | -85.7 | 3 | 3 | 2 | 24 | 283.435 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.84 | 7.15 | -42.07 | 2 | 3 | 1 | 23 | 282.427 | 8 | ↓ |