In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2010 | 16 | Yes |
Popular Name: N-tert-butyl-N'-[2-[(2S)-tetrahydrofuran-2-yl]ethyl]propane-1,3-diamine N-tert-butyl-N'-[2-[(2S)-tetrahy…
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) | 1.27 | 5.18 | -101.33 | 4 | 3 | 2 | 42 | 230.396 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.27 | 3.82 | -33.84 | 3 | 3 | 1 | 38 | 229.388 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.27 | 3.94 | -37.03 | 3 | 3 | 1 | 38 | 229.388 | 8 | ↓ |