In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 16 | Yes |
Popular Name: N,N-dimethyl-N'-[3-(trifluoromethyl)-2-pyridyl]ethane-1,2-diamine N,N-dimethyl-N'-[3-(trifluoromet…
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) | 1.77 | 6.04 | -36.98 | 2 | 3 | 1 | 29 | 234.245 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.77 | 3.51 | -4.46 | 1 | 3 | 0 | 28 | 233.237 | 5 | ↓ |