In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 13 | Yes |
Popular Name: (2S)-N2-ethyl-N2-[[(2R)-tetrahydrofuran-2-yl]methyl]propane-1,2-diamine (2S)-N2-ethyl-N2-[[(2R)-tetrahyd…
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) | 0.23 | 1.77 | -41.17 | 3 | 3 | 1 | 40 | 187.307 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.23 | 3.42 | -114.32 | 4 | 3 | 2 | 41 | 188.315 | 5 | ↓ |