In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 18 | Yes |
Popular Name: (3S,4S)-N4-ethyl-N3-isopropyl-N3-(2,2,2-trifluoroethyl)tetrahydropyran-3,4-diamine (3S,4S)-N4-ethyl-N3-isopropyl-N3…
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) | 2.19 | 4.27 | -29.41 | 2 | 3 | 1 | 29 | 269.331 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.19 | 5.62 | -110.05 | 3 | 3 | 2 | 30 | 270.339 | 6 | ↓ |