In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 14 | Yes |
Popular Name: (2R,3R)-N2,N3-diethyl-N3-(2-methoxyethyl)butane-2,3-diamine (2R,3R)-N2,N3-diethyl-N3-(2-meth…
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) | 1.52 | 3.11 | -33.59 | 2 | 3 | 1 | 29 | 203.35 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.52 | 2.05 | -1.84 | 1 | 3 | 0 | 24 | 202.342 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.52 | 3.92 | -28.49 | 2 | 3 | 1 | 26 | 203.35 | 8 | ↓ |