In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 25th, 2009 | 11 | Yes |
Popular Name: (3R,4S)-N3-ethyl-N3-methyl-tetrahydropyran-3,4-diamine (3R,4S)-N3-ethyl-N3-methyl-tetra…
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) | -0.32 | -0.67 | -39.82 | 3 | 3 | 1 | 40 | 159.253 | 2 | ↓ |
Hi High (pH 8-9.5) | -0.32 | -0.98 | -2 | 2 | 3 | 0 | 38 | 158.245 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.31 | 1.36 | -114.71 | 4 | 3 | 2 | 41 | 160.261 | 2 | ↓ |