In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 13 | Yes |
Popular Name: (3R,4S)-N3-(2-methoxyethyl)-N3-methyl-tetrahydropyran-3,4-diamine (3R,4S)-N3-(2-methoxyethyl)-N3-m…
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) | -0.71 | -1.55 | -37.56 | 3 | 4 | 1 | 49 | 189.279 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.71 | -1.84 | -3.08 | 2 | 4 | 0 | 48 | 188.271 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.71 | 0.5 | -110.64 | 4 | 4 | 2 | 51 | 190.287 | 4 | ↓ |