In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 14 | Yes |
Popular Name: (2S,3R)-N2-ethyl-N2-[[(2S)-tetrahydrofuran-2-yl]methyl]butane-2,3-diamine (2S,3R)-N2-ethyl-N2-[[(2S)-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) | 0.63 | 2.01 | -40.56 | 3 | 3 | 1 | 40 | 201.334 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.63 | 3.26 | -27.55 | 3 | 3 | 1 | 40 | 201.334 | 5 | ↓ |