In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2008 | 21 | Yes |
Popular Name: 3-isobutoxy-N-[[4-(trifluoromethylsulfanyl)phenyl]methyl]propan-1-amine 3-isobutoxy-N-[[4-(trifluorometh…
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) | 6.86 | 9.02 | -47.75 | 2 | 2 | 1 | 26 | 322.416 | 10 | ↓ |
Hi High (pH 8-9.5) | 6.86 | 7.6 | -3.36 | 1 | 2 | 0 | 21 | 321.408 | 10 | ↓ |