In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 16 | Yes |
Popular Name: N'-ethyl-N-[(1S)-1-methylpropyl]-N'-[[(2S)-tetrahydrofuran-2-yl]methyl]ethane-1,2-diamine N'-ethyl-N-[(1S)-1-methylpropyl]…
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) | 2.09 | 4.48 | -34.7 | 2 | 3 | 1 | 29 | 229.388 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.09 | 3.28 | -2.74 | 1 | 3 | 0 | 24 | 228.38 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.09 | 5.46 | -30.29 | 2 | 3 | 1 | 26 | 229.388 | 8 | ↓ |