In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 5th, 2008 | 16 | Yes |
Popular Name: N-ethyl-N-[(2-fluorophenyl)methyl]-N',N'-dimethyl-ethane-1,2-diamine N-ethyl-N-[(2-fluorophenyl)methy…
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) | 2.26 | 6.84 | -31.22 | 1 | 2 | 1 | 8 | 225.331 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.26 | 4.2 | -3.54 | 0 | 2 | 0 | 6 | 224.323 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.26 | 7.12 | -34.21 | 1 | 2 | 1 | 8 | 225.331 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.26 | 9.08 | -103.64 | 2 | 2 | 2 | 9 | 226.339 | 6 | ↓ |