In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2008 | 19 | Yes |
Popular Name: (1S)-N-isopropyl-N-methyl-1-[4-(trifluoromethoxy)phenyl]ethane-1,2-diamine (1S)-N-isopropyl-N-methyl-1-[4-(…
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) | 2.37 | 5.37 | -131.97 | 4 | 3 | 2 | 41 | 278.318 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.37 | 3.19 | -47.79 | 3 | 3 | 1 | 40 | 277.31 | 6 | ↓ |